SCHEMBL7855698

SCHEMBL7855698

Cn1cncc1-c1nnn2c1cc(-c1cccc(Cl)c1)c1cc(C(O)c3ccc(Cl)cc3)ccc12

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 15/20 0.50
FNTB P49356 15/20 0.50
PGGT1B P53609 2/20 0.48
IDO1 P14902 2/20 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
SCHEMBL7855700 0.81 IDO1 (0.47) FNTAFNTBPGGT1BIDO1
SCHEMBL7854078 0.80 IDO1 (0.46) FNTAFNTBPGGT1BIDO1
SCHEMBL6556871 0.75 IDO1 (0.46) FNTAFNTBPGGT1BIDO1
SCHEMBL7094552 0.73 IDO1 (0.48) FNTAFNTBIDO1
SCHEMBL6987223 0.73 IDO1 (0.48) FNTAFNTBIDO1
SCHEMBL7217943 0.73 FNTA (0.44) FNTAFNTBPGGT1BIDO1
SCHEMBL7643839 0.72 FNTA (0.56) FNTAFNTBPGGT1BIDO1
SCHEMBL6010160 0.71 FNTA (0.78) FNTAFNTB
SCHEMBL7167060 0.70 FNTA (0.47) FNTAFNTBPGGT1BIDO1
SCHEMBL7645791 0.70 FNTA (0.51) FNTAFNTBPGGT1BIDO1

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-1140935-A2 1,2-ANNELATED QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2001-10-10 EP disclosed
WO-2000039082-A2 1,2-ANNELATED QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2000-07-06 WO disclosed