SCHEMBL3966252

SCHEMBL3966252

Cc1c(CC(=O)O)c2ccc(F)cn2c1Cc1cccn1S(=O)(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 19/20 0.55
PTGDR Q13258 6/20 0.49
RAPGEF4 Q8WZA2 1/20 0.37
CYP2C9 P11712 1/20 0.35

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
SCHEMBL3970978 0.90 PTGDR2 (0.49) PTGDR2PTGDRRAPGEF4CYP2C9
SCHEMBL3974788 0.87 PTGDR2 (0.46) PTGDR2PTGDRRAPGEF4
SCHEMBL3971663 0.86 PTGDR2 (0.45) PTGDR2PTGDRRAPGEF4
SCHEMBL3968730 0.82 PTGDR2 (0.42) PTGDR2PTGDRRAPGEF4
SCHEMBL3970095 0.79 RAPGEF4 (0.43) PTGDR2PTGDRRAPGEF4
SCHEMBL3969343 0.79 PTGDR2 (0.39) PTGDR2PTGDRRAPGEF4
SCHEMBL13882017 0.79 PPARG (0.40) PTGDR2PTGDRRAPGEF4
SCHEMBL3966242 0.78 PTGDR2 (0.38) PTGDR2PTGDRRAPGEF4
SCHEMBL3972665 0.78 PTGDR2 (0.38) PTGDR2PTGDRRAPGEF4
SCHEMBL3964356 0.78 PTGDR2 (0.39) PTGDR2PTGDRRAPGEF4

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
WO-2009044147-A1 INDOLIZINE DERIVATIVES WITH CRTH2 RECEPTOR AFFINITY FOR THE TREATMENT OF INFLAMMATORY DISEASES ARGENTA DISCOVERY LIMITED (GB) 2009-04-09 WO disclosed