SCHEMBL8561443

SCHEMBL8561443

CCCCCCc1ccc(OC)c(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.56
PPARA Q07869 1/20 0.56
SMPD1 P17405 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL13242140 0.93 MAPT (0.50) PPARGPPARAMAPT
SCHEMBL22748859 0.87 PPARG (0.60) PPARGPPARA
SCHEMBL12844280 0.86 MAPT (0.53) MAPT
SCHEMBL28509682 0.85 S1PR2 (0.55) MAPT
SCHEMBL10771261 0.84 PPARG (0.65) PPARGPPARA
SCHEMBL10774024 0.84 PPARG (0.65) PPARGPPARA
SCHEMBL10773021 0.84 PPARG (0.65) PPARGPPARA
SCHEMBL3872175 0.82 PPARG (0.62) PPARGPPARA
SCHEMBL14122353 0.81 PPARG (0.57) PPARGPPARAMAPT
SCHEMBL4737345 0.80 GPR3 (0.54) PPARA

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-0653426-B1 Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same KOWA CO (JP) 1998-07-22 EP disclosed
US-5510366-A INOTROPIC, ANTIARRHYMTHMIA AGENTS, VASODILATORS KOWA CO., LTD. (JP) 1996-04-23 US disclosed
EP-0653426-A1 Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same KOWA COMPANY, LTD. (JP) 1995-05-17 EP disclosed