SCHEMBL2739929

SCHEMBL2739929

CC(C)C(=O)N1CCC(F)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 1/20 0.48
DPP4 P27487 6/20 0.46
DPP8 Q6V1X1 1/20 0.46
DPP9 Q86TI2 1/20 0.46
CHRNB2 P17787 1/20 0.45
CHRNA3 P32297 1/20 0.45
CHRNA4 P43681 1/20 0.45
CHRNB3 Q05901 1/20 0.45
CHRNA6 Q15825 1/20 0.45
EPHX2 P34913 2/20 0.43
DPP7 Q9UHL4 2/20 0.41
NAMPT P43490 1/20 0.39
SMYD3 Q9H7B4 1/20 0.38
NPY5R Q15761 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18347984 0.87 DPP4 (0.60) DPP4DPP8DPP9CHRNB2CHRNA3
SCHEMBL2739933 0.87 DPP4 (0.60) DPP4DPP8DPP9CHRNB2CHRNA3
SCHEMBL18347948 0.87 DPP4 (0.60) DPP4DPP8DPP9CHRNB2CHRNA3
SCHEMBL3059596 0.84 MEN1 (0.47) MEN1ALDH1A1KMT2ADPP4DPP8
Hydrochloric Acid SCHEMBL17796058 0.83 GNAI3 (0.46) MEN1ALDH1A1KMT2ADPP4DPP8
SCHEMBL30364025 0.83 SMYD3 (0.52) MEN1ALDH1A1KMT2ADPP4DPP8
SCHEMBL18711389 0.82 MEN1 (0.48) MEN1ALDH1A1KMT2ADPP4CHRNB2
SCHEMBL619146 0.82 MEN1 (0.48) MEN1ALDH1A1KMT2ADPP4CHRNB2
SCHEMBL2606047 0.82 ALDH1A1 (0.70) MEN1ALDH1A1KMT2ACHRNB2CHRNA3
SCHEMBL19419468 0.81 MEN1 (0.48) MEN1ALDH1A1KMT2ADPP4DPP8

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11718628-B2 SREBP inhibitors comprising a 6-membered central ring CAPULUS THERAPEUTICS, LLC (US) 2023-08-08 US disclosed
US-20210047340-A1 SREBP INHIBITORS COMPRISING A 6-MEMBERED CENTRAL RING CAPULUS THERAPEUTICS, LLC 2021-02-18 US disclosed
US-10745356-B2 Compositions and methods for treating tuberculosis THE BROAD INSTITUTE, INC. (US) 2020-08-18 US disclosed
US-20190284140-A1 COMPOSITIONS AND METHODS FOR TREATING TUBERCULOSIS THE BROAD INSTITUTE, INC. 2019-09-19 US disclosed
US-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 US disclosed
US-10246429-B2 Vinyl fluoride cyclopropyl fused thiazin-2-amine compounds as beta-secretase inhibitors and methods of use AMGEN INC. (US) 2019-04-02 US disclosed
US-20180222876-A1 VINYL FLUORIDE CYCLOPROPYL FUSED THIAZIN-2-AMINE COMPOUNDS AS BETA-SECRETASE INHIBITORS AND METHODS OF USE AMGEN INC. (US) 2018-08-09 US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 US disclosed
US-20150038460-A1 6,5-Heterocyclic Propargylic Alcohol Compounds and Uses Therefor GENENTECH, INC. (US) 2015-02-05 US disclosed
US-20100168084-A1 Therapeutic compounds and related methods of use ELIXIR PHARMACEUTICALS, INC. 2010-07-01 US disclosed
US-20090105246-A1 Sirtuin modulating compounds SIRTRIS PHARMACEUTICALS, INC. (US) 2009-04-23 US disclosed
US-20090099170-A1 Sirtuin modulating compounds SIRTRIS PHARMACEUTICALS, INC. (US) 2009-04-16 US disclosed
US-20090012080-A1 Sirtuin modulating compounds SIRTRIS PHARMACEUTICALS, INC. (US) 2009-01-08 US disclosed
US-7345178-B2 Sirtuin modulating compounds SIRTRIS PHARMACEUTICALS, INC. (US) 2008-03-18 US disclosed
US-20070043050-A1 Sirtuin modulating compounds SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-22 US disclosed
US-20070037827-A1 Silent Information Regulators; aging or stress, diabetes, obesity, neurodegenerative diseases, cardiovascular disease, blood clotting , increased mitochondrial activity, inflammation, cancer, and/or flushing; increased lifespan specially in mutant sir2 strains; imidazo[1,2-a]pyridine drivatives SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 US disclosed
US-20070037827-A1 Silent Information Regulators; aging or stress, diabetes, obesity, neurodegenerative diseases, cardiovascular disease, blood clotting , increased mitochondrial activity, inflammation, cancer, and/or flushing; increased lifespan specially in mutant sir2 strains; imidazo[1,2-a]pyridine drivatives SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 US disclosed
US-20070037865-A1 Silent Information Regulators; aging or stress, diabetes, obesity, neurodegenerative diseases, cardiovascular disease, blood clotting , increased mitochondrial activity, inflammation, cancer, and/or flushing; increased lifespan specially in mutant sir2 strains; benzimidazo drivatives SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 US disclosed
US-20070037810-A1 Sirtuin modulating compounds SIRTIS PHARMACEUTICALS, INC. (US) 2007-02-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (17 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11718628-B2 SREBP inhibitors comprising a 6-membered central ring SREBF1, SREBF2, XBP1 MEN1 2834/4885ALDH1A1 2993/4885KMT2A 4372/4885
US-10745356-B2 Compositions and methods for treating tuberculosis C5, IFNG, TERT MEN1 2513/4885ALDH1A1 1848/4885KMT2A 3608/4885
US-20090012080-A1 Sirtuin modulating compounds SIRT1, SIRT3, SIRT2 MEN1 3137/4885ALDH1A1 1825/4885KMT2A 1087/4885
US-20180222876-A1 VINYL FLUORIDE CYCLOPROPYL FUSED THIAZIN-2-AMINE COMPOUNDS AS BETA-SECRETASE INHIBITORS AND METHODS OF USE BACE1, BACE2, APP MEN1 3622/4885ALDH1A1 1466/4885KMT2A 2867/4885
US-20090099170-A1 Sirtuin modulating compounds SIRT1, SIRT3, SIRT2 MEN1 3137/4885ALDH1A1 1825/4885KMT2A 1087/4885
US-20070037827-A1 Silent Information Regulators; aging or stress, diabetes, obesity, neurodegenerative diseases, cardiovascular disease, blood clotting , increased mitochondrial activity, inflammation, cancer, and/or flushing; increased lifespan specially in mutant sir2 strains; imidazo[1,2-a]pyridine drivatives SIRT2, SIRT1, SIRT3 MEN1 2936/4885ALDH1A1 1700/4885KMT2A 402/4885
US-20190284140-A1 COMPOSITIONS AND METHODS FOR TREATING TUBERCULOSIS C5, IFNG, TERT MEN1 2513/4885ALDH1A1 1848/4885KMT2A 3608/4885
US-20210047340-A1 SREBP INHIBITORS COMPRISING A 6-MEMBERED CENTRAL RING SREBF1, SREBF2, XBP1 MEN1 2834/4885ALDH1A1 2993/4885KMT2A 4372/4885
US-20090105246-A1 Sirtuin modulating compounds SIRT1, SIRT3, SIRT2 MEN1 3137/4885ALDH1A1 1825/4885KMT2A 1087/4885
US-10246429-B2 Vinyl fluoride cyclopropyl fused thiazin-2-amine compounds as beta-secretase inhibitors and methods of use BACE1, BACE2, APP MEN1 3622/4885ALDH1A1 1466/4885KMT2A 2867/4885
US-20100168084-A1 Therapeutic compounds and related methods of use EP300, KAT2A, KAT6B MEN1 2682/4885ALDH1A1 618/4885KMT2A 422/4885
US-20070037865-A1 Silent Information Regulators; aging or stress, diabetes, obesity, neurodegenerative diseases, cardiovascular disease, blood clotting , increased mitochondrial activity, inflammation, cancer, and/or flushing; increased lifespan specially in mutant sir2 strains; benzimidazo drivatives SIRT2, SIRT1, SIRT3 MEN1 2548/4885ALDH1A1 1903/4885KMT2A 417/4885
US-20070043050-A1 Sirtuin modulating compounds SIRT1, SIRT3, SIRT2 MEN1 3085/4885ALDH1A1 1331/4885KMT2A 761/4885
US-10258603-B2 Therapeutic compounds and uses thereof BRD4, BRDT, BRD3 MEN1 1364/4885ALDH1A1 1563/4885KMT2A 165/4885
US-20150038460-A1 6,5-Heterocyclic Propargylic Alcohol Compounds and Uses Therefor NFKB1, NFRKB, NFKBIA MEN1 2445/4885ALDH1A1 253/4885KMT2A 4146/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 MEN1 1364/4885ALDH1A1 1563/4885KMT2A 165/4885
US-20070037810-A1 Sirtuin modulating compounds SIRT1, SIRT3, SIRT2 MEN1 3085/4885ALDH1A1 1331/4885KMT2A 761/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.