SCHEMBL2503293

SCHEMBL2503293

OB(O)c1cccc(CS)c1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 8/20 0.67
LPL P06858 2/20 0.55
LIPG Q9Y5X9 2/20 0.55
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
FOLH1 Q04609 1/20 0.47
MGLL Q99685 2/20 0.47
IDO1 P14902 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
EPHX1 P07099 1/20 0.39
F11 P03951 1/20 0.39

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
SCHEMBL5872608 0.82 ENPP2 (0.72) ENPP2LPLLIPGKDM4EALDH1A1
SCHEMBL8832 0.80 ENPP2 (1.00) ENPP2LPLLIPGKDM4EALDH1A1
SCHEMBL257748 0.78 ENPP2 (0.67) ENPP2LPLLIPGKDM4EALDH1A1
SCHEMBL2230985 0.78 ENPP2 (0.67) ENPP2LPLLIPGKDM4EALDH1A1
SCHEMBL723106 0.78 ENPP2 (0.67) ENPP2LPLLIPGKDM4EALDH1A1
SCHEMBL19952 0.78 ENPP2 (0.67) ENPP2LPLLIPGKDM4EALDH1A1
SCHEMBL692342 0.78 ENPP2 (0.67) ENPP2LPLLIPGKDM4EALDH1A1
SCHEMBL14518706 0.78 ENPP2 (0.67) ENPP2LPLLIPGKDM4EALDH1A1
SCHEMBL14120836 0.78 ENPP2 (0.67) ENPP2LPLLIPGKDM4EALDH1A1
Hydrochloric Acid SCHEMBL1490536 0.77 ENPP2 (0.64) ENPP2LPLLIPGKDM4EALDH1A1

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
CN-118056820-A 2, 4-Disubstituted thiophene compound and preparation method and application thereof 沈阳药科大学 2024-05-21 CN disclosed
EP-2681205-B1 BIARYL DERIVATIVES AS SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 2 INHIBITORS UNIV SAARLAND (DE) 2016-11-16 EP disclosed
US-20140057953-A1 BIARYL DERIVATIVES AS SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 2 INHIBITORS ELEXOPHARM GMBH (DE) 2014-02-27 US disclosed
US-20140012005-A1 PROCESS FOR PREPARING CHIRAL AMINO ACIDS DIVERCHIM (FR) 2014-01-09 US disclosed
EP-2681205-A1 BIARYL DERIVATIVES AS SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 2 INHIBITORS Universität des Saarlandes (DE) 2014-01-08 EP disclosed
US-8450522-B2 Conformationally constrained carboxylic acid derivatives useful for treating metabolic disorders AMGEN INC. (US) 2013-05-28 US disclosed
WO-2012117097-A1 BIARYL DERIVATIVES AS SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 2 INHIBITORS Universität des Saarlandes (DE) 2012-09-07 WO disclosed
US-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
EP-2260017-A1 CONFORMATIONALLY CONSTRAINED CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS Amgen, Inc (US) 2010-12-15 EP disclosed
US-20100298367-A1 Conformationally Constrained Carboxylic Acid Derivatives Useful for Treating Metabolic Disorders AMGEN INC. 2010-11-25 US disclosed
EP-2205548-A1 SUBSTITUTED BIPHENYL GPR40 MODULATORS Amgen, Inc (US) 2010-07-14 EP disclosed
WO-2009111056-A1 CONFORMATIONALLY CONSTRAINED CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS AMGEN INC. (US) 2009-09-11 WO disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 US disclosed
WO-2009048527-A1 SUBSTITUTED BIPHENYL GPR40 MODULATORS AMGEN INC. (US) 2009-04-16 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 (4 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-20090137561-A1 Substituted biphenyl GPR40 modulators GPR119, GPR65, GPR55 ENPP2 350/4885LPL 468/4885LIPG 556/4885
US-20100298367-A1 Conformationally Constrained Carboxylic Acid Derivatives Useful for Treating Metabolic Disorders PC, GOT2, CS ENPP2 1252/4885LPL 670/4885LIPG 491/4885
US-20140012005-A1 PROCESS FOR PREPARING CHIRAL AMINO ACIDS BCAT1, DNPEP, BCAT2 ENPP2 2671/4885LPL 4001/4885LIPG 4349/4885
US-20140057953-A1 BIARYL DERIVATIVES AS SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 2 INHIBITORS HSD17B2, HSD17B1, HSD3B2 ENPP2 793/4885LPL 464/4885LIPG 676/4885

“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.