SCHEMBL6601904

SCHEMBL6601904

Cc1oc(-c2ccc(Cl)cc2)nc1CCOS(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.53
LMNA P02545 1/20 0.50
TARBP2 Q15633 1/20 0.50
PPARA Q07869 7/20 0.49
PPARG P37231 7/20 0.49
POLB P06746 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
MAPK1 P28482 1/20 0.49
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL6293717 0.90 PPARG (0.50) HSD17B10LMNATARBP2PPARAPPARG
SCHEMBL6290491 0.89 HSD17B10 (0.55) HSD17B10LMNATARBP2PPARAPPARG
SCHEMBL6289197 0.88 PPARG (0.51) PPARAPPARGPOLBTP53
SCHEMBL6293798 0.87 PPARA (0.53) PPARAPPARG
SCHEMBL3578702 0.87 PPARG (0.55) TARBP2PPARAPPARGPOLBTP53
SCHEMBL821405 0.87 PPARG (0.59) PPARAPPARGHPGD
SCHEMBL3584058 0.86 PPARG (0.45) HSD17B10LMNAPPARAPPARGPOLB
SCHEMBL6289729 0.86 MEN1 (0.53) HSD17B10LMNATARBP2PPARAPPARG
SCHEMBL13807058 0.86 PPARG (0.48) PPARAPPARG
SCHEMBL3991636 0.85 PPARG (0.53) HSD17B10TARBP2PPARAPPARGPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1398313-A1 NOVEL HETEROCYCLIC DERIVATIVES AND MEDICINAL USE THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 2004-03-17 EP disclosed