SCHEMBL7424650

SCHEMBL7424650

N=C(N)c1cccc(COc2cccc3ccc(=O)n(-c4cccc(C(=N)N)c4)c23)c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F2 P00734 9/20 0.54
F10 P00742 2/20 0.47
MRGPRX4 Q96LA9 1/20 0.44
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL7427280 0.84 F2 (0.55) F2F10MRGPRX4
SCHEMBL7425231 0.81 F10 (0.47) F2F10
SCHEMBL7430819 0.81 F2 (0.52) F2F10
SCHEMBL7434152 0.81 F2 (0.63) F2F10
SCHEMBL7424278 0.80 F2 (0.65) F2F10MRGPRX4
SCHEMBL14599543 0.72 F2 (0.97) F2F10MRGPRX4
SCHEMBL7432569 0.69 F10 (0.49) F2F10
SCHEMBL7430323 0.69 F2 (0.65) F2F10
SCHEMBL7432426 0.69 F10 (0.49) F2F10MRGPRX4
SCHEMBL7423194 0.68 F2 (0.67) F2F10

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