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SCHEMBL6480099

SCHEMBL6480099

COCCOc1ccc(-c2ccc(C(=O)N(C)Cc3cccc(-c4ccc(CC5SC(=O)NC5=O)cc4)c3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 7/20 0.58
▸ PPARG P37231 10/20 0.51
▸ MPC2 O95563 1/20 0.51
▸ CYP2C8 P10632 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ HSD17B2 P37059 3/20 0.51
▸ PPARA Q07869 1/20 0.48
▸ RARG P13631 1/20 0.46
▸ RXRA P19793 1/20 0.46
▸ HSD17B1 P14061 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
SCHEMBL5395820 0.95 FFAR1 (0.55) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6473690 0.93 FFAR1 (0.58) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6183176 0.92 FFAR1 (0.59) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6478590 0.92 FFAR1 (0.59) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6184708 0.91 FFAR1 (0.60) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6183075 0.91 HSD17B2 (0.59) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6473015 0.91 HSD17B2 (0.59) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6477701 0.90 FFAR1 (0.57) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6472881 0.90 FFAR1 (0.57) FFAR1PPARGMPC2CYP2C8CYP2C9
SCHEMBL6477719 0.90 FFAR1 (0.57) FFAR1PPARGMPC2CYP2C8CYP2C9

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-6908939-B2 Biaromatic ligand activators of PPARγ receptors GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2005-06-21 — — US claimed