SCHEMBL7087432

SCHEMBL7087432

CC(C(=O)Nc1cccc(-c2ccc(CC3SC(=O)NC3=O)cc2)c1)c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.48
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PPARG P37231 7/20 0.41
PPARA Q07869 1/20 0.41
MPC2 O95563 1/20 0.40
CYP2C8 P10632 1/20 0.40
CYP2C9 P11712 1/20 0.40
MAOA P21397 2/20 0.39
CISD1 Q9NZ45 2/20 0.39
MAOB P27338 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL7559661 0.90 FFAR1 (0.51) FFAR1MAPTPPARGPPARAMPC2
SCHEMBL7560832 0.87 FFAR1 (0.52) FFAR1MAPTSMN1; SMN2PPARG
SCHEMBL6183947 0.81 FFAR1 (0.58) FFAR1MAPTPPARGPPARAMPC2
SCHEMBL6184770 0.79 FFAR1 (0.59) FFAR1MAPTPPARGPPARAMPC2
SCHEMBL5395849 0.79 FFAR1 (0.57) FFAR1MAPTPPARGPPARAMPC2
SCHEMBL7563417 0.79 FFAR1 (0.56) FFAR1PPARG
SCHEMBL6184667 0.77 FFAR1 (0.59) FFAR1MAPTSMN1; SMN2PPARGPPARA
SCHEMBL6185534 0.76 FFAR1 (0.65) FFAR1MAPTPPARGPPARAMPC2
SCHEMBL6184382 0.76 FFAR1 (0.48) FFAR1MAPTPPARGPPARAMPC2
SCHEMBL6480621 0.75 FFAR1 (0.54) FFAR1MAPTPPARGMPC2CYP2C8

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
WO-2002012210-A9 BIPHENYL DERIVATIVES AND THEIR USE AS PPAR-GAMMA RECEPTOR ACTIVATORS GALDERMA RES & DEV (FR) 2002-04-18 WO claimed
EP-1309575-A1 BIPHENYL DERIVATIVES AND THEIR USE AS PPAR-GAMMA RECEPTOR ACTIVATORS Galderma Research & Development (FR) 2003-05-14 EP disclosed
WO-2002012210-A1 BIPHENYL DERIVATIVES AND THEIR USE AS PPAR-GAMMA RECEPTOR ACTIVATORS GALDERMA RESEARCH & DEVELOPMENT (FR) 2002-02-14 WO disclosed