SCHEMBL5230197

SCHEMBL5230197

NC(CO)Cc1cccc(Oc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
SCN9A Q15858 4/20 0.48
FDFT1 P37268 2/20 0.48
PCNA P12004 1/20 0.47
LIG1 P18858 1/20 0.47
TAAR1 Q96RJ0 2/20 0.46
FFAR1 O14842 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL12379287 0.86 LTA4H (0.60) EPHX1PPARGPPARASCN9APCNA
SCHEMBL12379282 0.86 LTA4H (0.60) EPHX1PPARGPPARASCN9APCNA
Hydrochloric Acid SCHEMBL2287546 0.85 LTA4H (0.58) EPHX1PPARGPPARASCN9APCNA
Hydrochloric Acid SCHEMBL6479299 0.85 LTA4H (0.58) EPHX1PPARGPPARASCN9APCNA
Hydrochloric Acid SCHEMBL6479293 0.85 LTA4H (0.58) EPHX1PPARGPPARASCN9APCNA
Hydrochloric Acid SCHEMBL2296279 0.85 LTA4H (0.58) EPHX1PPARGPPARASCN9APCNA
Hydrochloric Acid SCHEMBL2287540 0.85 LTA4H (0.58) EPHX1PPARGPPARASCN9APCNA
SCHEMBL5225775 0.83 FDFT1 (0.46) EPHX1PPARGPPARASCN9AFDFT1
L-Phenylalaninol SCHEMBL8174775 0.83 PPARG (0.54) EPHX1PPARGPPARASCN9APCNA
SCHEMBL30942602 0.82 ALDH1A1 (0.56) FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1092435-B1 REMEDIES FOR DIABETES KYOWA HAKKO KOGYO KK (JP) 2007-04-04 EP disclosed
US-6489331-B1 A CONDENSED PURINE DERIVATIVE AS AN ACTIVE INGREDIENT AS AN ENHANCER OF INSULIN SECRETION AND A MEDICAMENT FOR THE TREATMENT OF DIABETES KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-12-03 US disclosed
EP-1092435-A1 REMEDIES FOR DIABETES KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-04-18 EP disclosed