SCHEMBL13882017

SCHEMBL13882017

Cc1c(CC(=O)O)c2ccc(N)cn2c1Cc1cccn1S(=O)(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.40
PPARD Q03181 2/20 0.40
PPARA Q07869 2/20 0.40
PTGDR2 Q9Y5Y4 12/20 0.39
PTGDR Q13258 3/20 0.38
RAPGEF4 Q8WZA2 2/20 0.36
HTR6 P50406 2/20 0.35
NOD1 Q9Y239 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34

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
SCHEMBL3967784 0.80 RAPGEF4 (0.35) PPARGPPARDPPARAPTGDR2RAPGEF4
SCHEMBL3966252 0.79 PTGDR2 (0.55) PTGDR2PTGDRRAPGEF4
SCHEMBL13881864 0.79 PTGDR2 (0.41) PTGDR2PTGDRRAPGEF4HTR6
SCHEMBL3969343 0.77 PTGDR2 (0.39) PTGDR2PTGDRRAPGEF4HTR6
SCHEMBL3968730 0.77 PTGDR2 (0.42) PTGDR2PTGDRRAPGEF4HTR6
SCHEMBL3974788 0.76 PTGDR2 (0.46) PTGDR2PTGDRRAPGEF4
SCHEMBL3971663 0.75 PTGDR2 (0.45) PTGDR2PTGDRRAPGEF4HTR6
SCHEMBL3966242 0.75 PTGDR2 (0.38) PTGDR2PTGDRRAPGEF4HTR6
SCHEMBL3970095 0.74 RAPGEF4 (0.43) PTGDR2PTGDRRAPGEF4HTR6
SCHEMBL3972665 0.73 PTGDR2 (0.38) PTGDR2PTGDRRAPGEF4HTR6

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