SCHEMBL8692541

SCHEMBL8692541

O=C1SC(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)C(=O)N1Cc1cccc2[nH]ccc12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 5/20 0.41
▸ TACR1 P25103 5/20 0.40
▸ DAO P14920 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35
▸ GLRA3 O75311 1/20 0.35
▸ GLRB P48167 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ OPRL1 P41146 1/20 0.34
▸ ATM Q13315 1/20 0.33

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
SCHEMBL8687698 0.88 TACR1 (0.49) TACR1KMT2AMEN1MAPTTRPV1
SCHEMBL8687830 0.79 TACR1 (0.45) TACR1KMT2AMEN1MAPTGLRA3
SCHEMBL8686712 0.76 TACR1 (0.40) TACR1DAOKMT2AMEN1MAPT
SCHEMBL8687131 0.74 TACR1 (0.53) TACR1PPARGKMT2AMEN1MAPT
SCHEMBL8688100 0.72 ESRRA (0.44) C5AR1
SCHEMBL8687062 0.70 DAO (0.39) TACR1DAOKMT2AMEN1MAPT
SCHEMBL8686947 0.67 MAPT (0.37) DAOKMT2AMEN1MAPTHSD17B10
SCHEMBL8692539 0.66 C5AR1 (0.39) C5AR1TACR1DAOKMT2AMEN1
SCHEMBL8688098 0.64 C5AR1 (0.38) C5AR1KMT2ATRPV1HSD17B10ATM
SCHEMBL8687249 0.63 ESRRA (0.45) —

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
US-5811439-A ANTIDIABETIC AGENTS; SIDE EFFECT REDUCTION; ANTILEPEMIC AGENTS SENGA PHARMACEUTICAL LABORATORY INC. (JP) 1998-09-22 — — US disclosed
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