SCHEMBL3412581

SCHEMBL3412581

CCN(Cc1ccccc1-c1cc(CC(=O)O)ccc1OC)C(=O)OCc1ccccc1

nearest known ligand 0.84

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.84
TBXA2R P21731 4/20 0.78
PTGDR Q13258 4/20 0.78
CYP3A4 P08684 2/20 0.78
CYP2C9 P11712 2/20 0.78
PTGIR P43119 2/20 0.78

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
SCHEMBL137489 0.91 PTGDR2 (0.83) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL139356 0.91 PTGDR2 (1.00) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL134982 0.91 PTGDR2 (1.00) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL137229 0.88 PTGDR2 (1.00) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL142883 0.88 PTGDR2 (1.00) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL137334 0.88 PTGDR2 (1.00) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL136287 0.87 PTGDR2 (1.00) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL137368 0.86 PTGDR2 (0.80) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL3405614 0.85 PTGDR2 (0.84) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL27821116 0.85 PTGDR2 (0.63) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9

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-2257524-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS Amira Pharmaceuticals, Inc. (US) 2010-12-08 EP disclosed
WO-2009099902-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed