SCHEMBL3982641

SCHEMBL3982641

N#Cc1cc(CC(=O)O)ccc1Oc1ccc(C(=O)N(c2ccc(Cl)cc2)C2CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 4/20 0.43
CHRM3 P20309 4/20 0.43
PTGDR2 Q9Y5Y4 10/20 0.42
LPAR1 Q92633 1/20 0.42
LPAR5 Q9H1C0 1/20 0.42
PTGDR Q13258 2/20 0.41
CYP2D6 P10635 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
STAT3 P40763 1/20 0.37

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
SCHEMBL2987852 0.83 PTGIR (0.46) PTGDR2LPAR1LPAR5PTGDRSTAT3
SCHEMBL2979645 0.79 OPRM1 (0.42) PTGDR2LPAR1LPAR5PTGDR
SCHEMBL2979609 0.76 PTGDR2 (0.61) PTGDR2PTGDRCYP2D6
SCHEMBL2991405 0.75 PTGDR2 (0.61) PTGDR2PTGDR
SCHEMBL2982722 0.75 PTGDR2 (0.51) PTGDR2PTGDR
SCHEMBL2986242 0.74 PTGDR2 (0.46) PTGDR2PTGDR
SCHEMBL2979643 0.73 PTGDR2 (0.62) PTGDR2PTGDRKMT2A
SCHEMBL2987848 0.73 PTGDR2 (0.49) PTGDR2PTGDR
SCHEMBL2982720 0.70 PTGDR2 (0.60) PTGDR2PTGDR
SCHEMBL12761132 0.70 KDM4E (0.64) PTGDR2PTGDRMEN1KMT2A

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-2057115-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES Array Biopharma, Inc. (US) 2009-05-13 EP disclosed
WO-2008024746-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES ARRAY BIOPHARMA, INC. (US) 2008-02-28 WO disclosed