SCHEMBL6987223

SCHEMBL6987223

Cn1cncc1-c1c(N)nc2ccc(C(O)c3ccc(Cl)cc3)cc2c1-c1cccc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.48
FNTA P49354 6/20 0.45
FNTB P49356 6/20 0.45
RORC P51449 7/20 0.38
FABP3 P05413 1/20 0.36
CYP2C9 P11712 1/20 0.36
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL7094552 0.91 IDO1 (0.48) IDO1FNTAFNTBRORCFABP3
SCHEMBL7090215 0.88 FNTA (0.48) IDO1FNTAFNTBRORC
SCHEMBL7094305 0.80 IDO1 (0.38) IDO1FNTAFNTB
SCHEMBL7855700 0.80 IDO1 (0.47) IDO1FNTAFNTB
SCHEMBL6556871 0.79 IDO1 (0.46) IDO1FNTAFNTB
SCHEMBL7854078 0.79 IDO1 (0.46) IDO1FNTAFNTB
SCHEMBL7086587 0.78 RORC (0.41) IDO1FNTAFNTBRORC
SCHEMBL7094385 0.76 IDO1 (0.48) IDO1FNTAFNTBRORCMAPK1
SCHEMBL7093092 0.75 FNTA (0.44) IDO1FNTAFNTBRORC
SCHEMBL7217940 0.75 FNTA (0.39) IDO1FNTAFNTBRORC

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-1322635-A1 FARNESYL TRANSFERASE INHIBITING QUINOLINE AND QUINAZOLINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-07-02 EP disclosed
WO-2002024682-A1 FARNESYL TRANSFERASE INHIBITING QUINOLINE AND QUINAZOLINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2002-03-28 WO disclosed