SCHEMBL10103697

SCHEMBL10103697

CC(C)c1ccc(F)cc1N

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.39
▸ GAA P10253 3/20 0.38
▸ HTT P42858 2/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ KEAP1 Q14145 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2A6 P11509 1/20 0.34
▸ TRPA1 O75762 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ ADRA1A P35348 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ POLB P06746 1/20 0.33
▸ GFER P55789 1/20 0.33

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
SCHEMBL8815246 0.82 ALDH1A1 (0.50) ALDH1A1L3MBTL1HRH4GAAHTT
SCHEMBL22304503 0.79 ALDH1A1 (0.41) ALDH1A1L3MBTL1HRH4GAASLC6A2
SCHEMBL21624294 0.79 ALDH1A1 (0.46) ALDH1A1L3MBTL1GAAHTTKEAP1
SCHEMBL2244195 0.79 ALDH1A1 (0.59) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL12197672 0.78 CYP1A2 (0.39) ALDH1A1HRH4HIF1ARECQLCYP1A2
SCHEMBL27668309 0.77 ALDH1A1 (0.40) ALDH1A1L3MBTL1GAAHTTKEAP1
SCHEMBL22289607 0.77 KEAP1 (0.42) ALDH1A1KEAP1HDAC1
SCHEMBL84105 0.76 CES2 (0.46) ALDH1A1RECQLCYP1A2CYP2A6TRPA1
SCHEMBL29368425 0.76 CASP1 (0.48) ALDH1A1L3MBTL1GAAHTTALOX12
SCHEMBL5486247 0.76 CASP1 (0.48) ALDH1A1L3MBTL1GAAHTTALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024130095-A9 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-08-02 — — WO disclosed
WO-2024130095-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-06-20 — — WO disclosed
WO-2023279986-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF 贝达药业股份有限公司 2023-01-12 — — WO disclosed
US-20220162209-A1 SALICYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2022-05-26 — — US disclosed
US-20210030899-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2021-02-04 — — US disclosed
US-10842891-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography THE GENERAL HOSPITAL CORPORATION (US) 2020-11-24 — — US disclosed
US-20190240357-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2019-08-08 — — US disclosed
EP-2731430-B1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-04-03 — — EP disclosed
EP-2731430-B1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-04-03 — — EP disclosed
US-10188756-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography THE GENERAL HOSPITAL CORPORATION (US) 2019-01-29 — — US disclosed
US-20130203593-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-08-08 — — US disclosed
US-20130203593-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-08-08 — — US disclosed
WO-2013116052-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-08-08 — — WO disclosed
WO-2013009791-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-01-17 — — WO disclosed
US-20130019348-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-01-17 — — US disclosed
WO-2013009791-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-01-17 — — WO disclosed
US-20130019348-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-01-17 — — US disclosed
US-20130019348-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-01-17 — — US disclosed
US-20120165335-A1 CDK INHIBITORS CURIS, INC. 2012-06-28 — — US disclosed
US-20120165335-A1 CDK INHIBITORS CURIS, INC. 2012-06-28 — — 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 (8 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-20190240357-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 ALDH1A1 513/4885L3MBTL1 2615/4885HRH4 103/4885
US-10188756-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 ALDH1A1 513/4885L3MBTL1 2615/4885HRH4 103/4885
US-20210030899-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 ALDH1A1 513/4885L3MBTL1 2615/4885HRH4 103/4885
US-20220162209-A1 SALICYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF ADSL, SLC35B2, ADORA1 ALDH1A1 136/4885L3MBTL1 3063/4885HRH4 2727/4885
US-20130203593-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO CYP19A1, CYP1A1, AR ALDH1A1 588/4885L3MBTL1 3142/4885HRH4 983/4885
US-20120165335-A1 CDK INHIBITORS CDK3, CDK6, CDKL1 ALDH1A1 3475/4885L3MBTL1 1464/4885HRH4 4115/4885
US-20130019348-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, CAT ALDH1A1 278/4885L3MBTL1 3362/4885HRH4 3943/4885
US-10842891-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 ALDH1A1 513/4885L3MBTL1 2615/4885HRH4 103/4885

“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.

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