SCHEMBL7434152

SCHEMBL7434152

N=C(N)c1cccc(COc2ccc3ccc(=O)n(-c4cccc(C(=N)N)c4)c3c2)c1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 14/20 0.63
F10 P00742 3/20 0.53
PRSS1 P07477 1/20 0.52
KLK5 Q9Y337 1/20 0.45

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
SCHEMBL7424278 0.93 F2 (0.65) F2F10PRSS1
SCHEMBL7430323 0.84 F2 (0.65) F2F10
SCHEMBL7423757 0.81 F2 (0.61) F2F10PRSS1
SCHEMBL7424650 0.81 F2 (0.54) F2F10
SCHEMBL7423194 0.79 F2 (0.67) F2F10
SCHEMBL7430809 0.76 F2 (0.63) F2F10
SCHEMBL7425222 0.76 F10 (0.47) F2F10PRSS1
SCHEMBL7429823 0.74 F10 (0.60) F2F10PRSS1
Hydrochloric Acid SCHEMBL34433766 0.71 F2 (1.00) F2F10PRSS1
Hydrochloric Acid SCHEMBL28553434 0.71 F2 (1.00) 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