SCHEMBL2487117

SCHEMBL2487117

COC(=O)Cc1cnc(C(=O)c2cccc(NC(=O)c3ccc(Cl)c(Cl)c3)c2)c2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.68

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
SCHEMBL1368075 0.90 PTGDR2 (0.84) PTGDR2
SCHEMBL1367254 0.81 PTGDR2 (1.00) PTGDR2
SCHEMBL1369395 0.80 PTGDR2 (0.57) PTGDR2
SCHEMBL2483862 0.79 PTGDR2 (0.66) PTGDR2
SCHEMBL2484454 0.78 PTGDR2 (0.84) PTGDR2
SCHEMBL2486140 0.75 PTGDR2 (0.58) PTGDR2
SCHEMBL2487116 0.73 PKM (0.48) PTGDR2
SCHEMBL1367192 0.73 PTGDR2 (1.00) PTGDR2
SCHEMBL1370449 0.71 PTGDR2 (0.68) PTGDR2
SCHEMBL1366773 0.70 PTGDR2 (0.53) PTGDR2

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
EP-2377851-A1 ISOQUINOLINE DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2011-10-19 EP disclosed