SCHEMBL7427399

SCHEMBL7427399

Cc1c(CC(=O)O)c(=O)n(Cc2ccc3ccc(C(=N)N)cc3c2)c2cc(Oc3cccc(C(=N)N)c3)ccc12

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.65
F2 P00734 16/20 0.65
PRSS1 P07477 10/20 0.65
PTGDR2 Q9Y5Y4 1/20 0.40

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
SCHEMBL7424892 0.93 F10 (0.53) F10F2PRSS1
SCHEMBL7430422 0.92 F10 (0.51) F10F2PRSS1
SCHEMBL7420509 0.91 F10 (0.68) F10F2PRSS1
SCHEMBL7433924 0.87 F10 (0.54) F10F2PRSS1
SCHEMBL7428513 0.86 F10 (0.52) F10F2PRSS1
SCHEMBL7433846 0.84 F10 (0.51) F10F2PRSS1
SCHEMBL7424253 0.83 F10 (0.52) F10F2PRSS1
SCHEMBL7430190 0.83 F10 (0.55) F10F2PRSS1
SCHEMBL7425811 0.82 F2 (0.72) F10F2PRSS1
SCHEMBL7427220 0.82 F10 (0.54) F10F2PRSS1

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-1107954-A1 2-OXO-$i(2H)-QUINOLINE DERIVATIVES MERCK PATENT GmbH (DE) 2001-06-20 EP disclosed
WO-2000012479-A1 2-OXO-2H-QUINOLINE DERIVATIVES MERCK PATENT GMBH (DE) 2000-03-09 WO disclosed