SCHEMBL7427280

SCHEMBL7427280

N=C(N)c1cccc(COc2cccc3ccc(=O)n(Cc4cccc(C(=N)N)c4)c23)c1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F2 P00734 7/20 0.55
F10 P00742 7/20 0.51
MRGPRX4 Q96LA9 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
SCHEMBL7430819 0.95 F2 (0.52) F2F10
SCHEMBL7432569 0.85 F10 (0.49) F2F10
SCHEMBL7424650 0.84 F2 (0.54) F2F10MRGPRX4
SCHEMBL7430323 0.80 F2 (0.65) F2F10
SCHEMBL7432426 0.80 F10 (0.49) F2F10MRGPRX4
SCHEMBL7423194 0.80 F2 (0.67) F2F10
SCHEMBL7433462 0.79 F10 (0.48) F2F10
SCHEMBL9950748 0.79 PTGER3 (0.45)
SCHEMBL7423757 0.76 F2 (0.61) F2F10
SCHEMBL7429233 0.76 F10 (0.57) F2F10MRGPRX4

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