SCHEMBL2175704

SCHEMBL2175704

C=CCOC(C(=O)O)C(C)c1ccc(-c2cccc(N(C)C(=O)NCCCCCCC)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 15/20 0.47
FAAH O00519 5/20 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
SCHEMBL2174736 0.90 PTGS2 (0.49) PTGS2FAAH
SCHEMBL2174614 0.87 PTGS2 (0.47) PTGS2FAAH
SCHEMBL2174987 0.86 PTGS2 (0.46) PTGS2FAAH
SCHEMBL2176316 0.84 PTGS2 (0.41) PTGS2
SCHEMBL2173342 0.84 PTGS2 (0.41) PTGS2
SCHEMBL2173346 0.84 PTGS2 (0.41) PTGS2
SCHEMBL2173697 0.83 PTGS2 (0.51) PTGS2FAAH
SCHEMBL2175633 0.83 PTGS2 (0.40) PTGS2
SCHEMBL2175630 0.83 PTGS2 (0.40) PTGS2
SCHEMBL2175701 0.81 PTGS2 (0.38) PTGS2FAAH

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
US-7973063-B2 Methods for activating PPAR gamma-type receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-07-05 US disclosed
EP-1742608-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϝ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-01-17 EP disclosed
WO-2005108352-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϜ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-11-17 WO disclosed