SCHEMBL2858447

SCHEMBL2858447

CCCCCCCNC(=O)N(C)c1cccc(-c2ccc(C[C@H](Nc3ccccc3C(=O)c3ccccc3)C(=O)OCc3cccc(OC)c3)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.43
PPARA Q07869 1/20 0.39
TACR1 P25103 1/20 0.38
PLG P00747 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 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
SCHEMBL2855297 0.94 PPARG (0.45) PPARGPPARA
SCHEMBL2859539 0.92 PPARG (0.43) PPARGPPARAPLGPRSS1PRSS2
SCHEMBL2847839 0.90 PPARG (0.47) PPARGPPARA
SCHEMBL2854100 0.89 PPARG (0.46) PPARGPPARA
SCHEMBL2849454 0.89 PPARG (0.48) PPARGPPARA
SCHEMBL2849756 0.88 PPARG (0.48) PPARG
SCHEMBL2852151 0.86 PPARG (0.51) PPARGPPARA
SCHEMBL2852146 0.86 PPARG (0.51) PPARGPPARA
SCHEMBL2853557 0.86 PPARG (0.45) PPARGPLGPRSS1PRSS2PRSS3
SCHEMBL2854583 0.86 PPARG (0.45) PPARGPLGPRSS1PRSS2PRSS3

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
EP-1575911-B1 BIAROMATIC COMPOUNDS WHICH ACTIVATE PPAR-GAMMA TYPE RECEPTORS AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2010-01-13 EP claimed