SCHEMBL5760199

SCHEMBL5760199

CCCOc1ccc2cc(C(=O)N(C)Cc3csc(-c4ccc([C@H](CC(=O)O)OCC)cc4)c3)ccc2c1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 19/20 0.43
PPARG P37231 1/20 0.38

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
SCHEMBL5763102 0.86 FFAR1 (0.42) FFAR1
SCHEMBL1749506 0.85 PPARA (0.43) PPARG
SCHEMBL1749507 0.85 PPARA (0.43) PPARG
SCHEMBL5763680 0.82 FFAR1 (0.41) FFAR1
SCHEMBL1748985 0.72 PPARA (0.50) PPARG
SCHEMBL1748986 0.72 PPARA (0.50) PPARG
SCHEMBL1749867 0.68 PPARA (0.43) PPARG
SCHEMBL5760058 0.68 PPARA (0.43) PPARG
SCHEMBL3949594 0.67 HSD17B2 (0.39) PPARG
SCHEMBL1749503 0.67 PPARA (0.44) PPARG

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
EP-1638964-A1 NOVEL COMPOUNDS THAT MODULATE PPAR-GAMMA TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2006-03-29 EP disclosed
WO-2004113331-A1 NOVEL COMPOUNDS THAT MODULATE PPARϜ TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-12-29 WO disclosed