SCHEMBL4145613

SCHEMBL4145613

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

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.55
▸ POLB P06746 3/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ LMNA P02545 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ KMT2A Q03164 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL26213401 0.89 PTPN1 (0.49) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL19841676 0.86 PTPN1 (0.52) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL19116660 0.84 TDP1 (0.59) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL16643863 0.84 PTPN1 (0.54) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL11889091 0.83 L3MBTL1 (0.45) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL24373554 0.82 PTPN1 (0.52) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL25854792 0.81 SMN1; SMN2 (0.50) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL12197944 0.81 ALDH1A1 (0.60) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL12932588 0.81 POLB (0.53) PTPN1POLBL3MBTL1KDM4ECYP2C9
SCHEMBL26997899 0.80 PTPN1 (0.47) PTPN1POLBL3MBTL1KDM4ECYP2C9

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 — — US disclosed
WO-2023168367-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS IMMUNESENSOR THERAPEUTICS, INC. (US) 2023-09-07 — — WO disclosed
US-20200207726-A1 INDOLINYL SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE LYCERA CORPORATION 2020-07-02 — — US disclosed
US-10202362-B2 Inhibitors of leukotriene A4 hydrolase CELTAXSYS, INC. (US) 2019-02-12 — — US disclosed
US-20180162836-A1 INHIBITORS OF LEUKOTRIENE A4 HYDROLASE CELLTAXIS, LLC 2018-06-14 — — US disclosed
US-9586931-B2 Triazolyl derivatives as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2017-03-07 — — US disclosed
US-9586931-B2 Triazolyl derivatives as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2017-03-07 — — US disclosed
US-20150239866-A1 TRIAZOLYL DERIVATIVES AS SYK INHIBITORS MERCK CANADA INC. (CA) 2015-08-27 — — US disclosed
US-8324265-B2 Heterocyclic compounds having type I 11β hydroxysteroid dehydrogenase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-12-04 — — US disclosed
EP-1960347-B1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 3 (17BETA-HSD3) INHIBITORS STERIX LTD (GB) 2012-06-20 — — EP disclosed
US-20090170832-A1 HETEROCYCLIC COMPOUNDS HAVING TYPE I 11beta HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2009-07-02 — — US disclosed
US-20090023710-A1 Compound OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2009-01-22 — — US disclosed
EP-1960347-A2 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 3 (17BETA-HSD3) INHIBITORS Sterix Limited (GB) 2008-08-27 — — EP disclosed
WO-2007003934-A2 17BETA-HYDR0XYSTER0ID DEHYDROGENASE TYPE 3 (17BETA-HSD3 ) INHIBITORS STERIX LIMITED (GB) 2007-01-11 — — WO 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 (7 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-20200207726-A1 INDOLINYL SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE RORA, RORC, RORB PTPN1 778/4885POLB 4324/4885L3MBTL1 4845/4885
US-20150239866-A1 TRIAZOLYL DERIVATIVES AS SYK INHIBITORS SYK, BTK, TYRO3 PTPN1 91/4885POLB 1695/4885L3MBTL1 4097/4885
US-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS PTPN1 3454/4885POLB 578/4885L3MBTL1 4285/4885
US-20090170832-A1 HETEROCYCLIC COMPOUNDS HAVING TYPE I 11beta HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY HSD17B1, HSD11B1, HSD3B1 PTPN1 2867/4885POLB 904/4885L3MBTL1 2378/4885
US-20090023710-A1 Compound NR1H3, NR1H2, NR1H4 PTPN1 2512/4885POLB 3790/4885L3MBTL1 2752/4885
US-20180162836-A1 INHIBITORS OF LEUKOTRIENE A4 HYDROLASE LTA4H, LTC4S, LTB4R PTPN1 2145/4885POLB 2412/4885L3MBTL1 1450/4885
US-10202362-B2 Inhibitors of leukotriene A4 hydrolase LTA4H, LTC4S, LTB4R PTPN1 2145/4885POLB 2412/4885L3MBTL1 1450/4885

“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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