SCHEMBL7428858

SCHEMBL7428858

CCOC(=O)c1cc2ccc(Oc3cccc(C(=N)N)c3)cc2n(Cc2ccc3ccc(C(=N)N)cc3c2)c1=O

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.59
F2 P00734 14/20 0.59
PRSS1 P07477 10/20 0.59

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
SCHEMBL7431654 0.93 F10 (0.58) F10F2PRSS1
SCHEMBL7427295 0.89 F10 (0.64) F10F2PRSS1
SCHEMBL7426338 0.83 F10 (0.61) F10F2PRSS1
SCHEMBL7428050 0.82 POLB (0.45) F10F2PRSS1
SCHEMBL7421334 0.81 F10 (0.58) F10F2PRSS1
SCHEMBL7420509 0.81 F10 (0.68) F10F2PRSS1
SCHEMBL7427399 0.79 F10 (0.65) F10F2PRSS1
SCHEMBL7430945 0.79 F2 (0.51) F10F2PRSS1
SCHEMBL7425811 0.78 F2 (0.72) F10F2PRSS1
SCHEMBL7427330 0.77 F10 (0.67) 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