SCHEMBL7425811

SCHEMBL7425811

Cc1cc(=O)n(Cc2ccc3ccc(C(=N)N)cc3c2)c2cc(Oc3cccc(C(=N)N)c3)ccc12

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F2 P00734 17/20 0.72
F10 P00742 17/20 0.72
PRSS1 P07477 10/20 0.72

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
SCHEMBL7430906 0.93 F10 (0.67) F2F10PRSS1
SCHEMBL7420509 0.84 F10 (0.68) F2F10PRSS1
SCHEMBL7427330 0.84 F10 (0.67) F2F10PRSS1
SCHEMBL7424887 0.83 F10 (0.56) F2F10PRSS1
SCHEMBL7427399 0.82 F10 (0.65) F2F10PRSS1
SCHEMBL7420549 0.80 F2 (0.60) F2F10PRSS1
SCHEMBL7428858 0.78 F10 (0.59) F2F10PRSS1
SCHEMBL7427295 0.78 F10 (0.64) F2F10PRSS1
SCHEMBL7433456 0.77 F10 (0.56) F2F10PRSS1
SCHEMBL7426338 0.76 F10 (0.61) F2F10PRSS1

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