SCHEMBL6256965

SCHEMBL6256965

CCOC(C(=O)O)C(O)c1ccc(-c2cccc(CNC)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.48
PRMT6 Q96LA8 5/20 0.44
BCL2 P10415 1/20 0.40
EPHX2 P34913 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
FFAR1 O14842 2/20 0.39
AOC3 Q16853 2/20 0.39
HTR7 P34969 1/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
FFAR4 Q5NUL3 1/20 0.38
ERAP2 Q6P179 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
LNPEP Q9UIQ6 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
SCHEMBL5403694 1.00 PTGS2 (0.48) PTGS2PRMT6BCL2EPHX2CYP3A4
SCHEMBL3949412 0.90 PRMT6 (0.43) PTGS2PRMT6BCL2EPHX2CYP3A4
SCHEMBL5394154 0.84 PTGS2 (0.42) PTGS2BCL2FFAR1AOC3PPARG
SCHEMBL5399548 0.79 PPARG (0.55) PPARGPPARA
SCHEMBL5399556 0.79 PPARG (0.55) PPARGPPARA
SCHEMBL6252542 0.78 RXRA (0.36) PTGS2CYP3A4CYP2D6SLC6A2SLC6A4
SCHEMBL5390373 0.78 RXRA (0.36) PTGS2CYP3A4CYP2D6SLC6A2SLC6A4
SCHEMBL5394147 0.77 AOC3 (0.47) PTGS2AOC3
SCHEMBL3950853 0.74 PRMT6 (0.45) PRMT6EPHX2FFAR1HTR7PPARG
SCHEMBL1252083 0.71 PRMT6 (0.73) PRMT6EPHX2CYP3A4FFAR1AOC3

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-1567509-A2 BIPHENYL COMPOUNDS WHICH ACTIVATE PPAR-GAMMA TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2005-08-31 EP disclosed
WO-2004048351-A2 BIPHENYL COMPOUNDS WHICH ACTIVATE PPAR-GAMMA TYPE RECEPTORS AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-06-10 WO disclosed