SCHEMBL9765591

SCHEMBL9765591

O=C1NC(=O)C(Cc2ccc(OCc3ccc4oc(-c5cccs5)nc4c3)cc2)S1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 13/20 0.54
▸ PPARA Q07869 6/20 0.54
▸ PPARG P37231 8/20 0.49
▸ MPC2 O95563 1/20 0.44
▸ CYP2C8 P10632 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ GFER P55789 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43

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
SCHEMBL8458654 0.80 FFAR1 (0.55) FFAR1PPARAPPARGMPC2CYP2C8
SCHEMBL9765576 0.79 HPGD (0.57) KDM4E
SCHEMBL9223431 0.78 KDM4E (0.50) FFAR1PPARAPPARGKDM4ENPC1
SCHEMBL9832866 0.77 FFAR1 (0.57) FFAR1PPARAPPARGMPC2CYP2C8
SCHEMBL8316232 0.75 FFAR1 (0.84) FFAR1PPARAPPARGMPC2CYP2C8
SCHEMBL6954017 0.75 PPARA (0.47) FFAR1PPARAPPARG
SCHEMBL9558560 0.75 PPARG (0.49) FFAR1PPARGKDM4ENPC1MAPT
SCHEMBL290976 0.74 UTRN (0.48) FFAR1PPARGKDM4ENPC1TP53
SCHEMBL29702319 0.74 UTRN (0.48) FFAR1PPARGKDM4ENPC1TP53
SCHEMBL8312136 0.74 FFAR1 (0.87) FFAR1PPARAPPARGMPC2CYP2C8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991019704-A2 OXA- AND THIAZOLIDINEDIONE HYPOGLYCEMIC AND HYPOCHOLESTEROLEMIC AGENTS PFIZER INC. (US) 1991-12-26 — — WO disclosed
US-5037842-A Oxa- and thiazolidinedione hypoglycemic and hypocholesterolemic agents PFIZER INC. (US) 1991-08-06 — — US disclosed
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