SCHEMBL7087587

SCHEMBL7087587

Cc1nc2ccc(C(O)c3nnc(S)n3C)cc2c(-c2cccc(Cl)c2)c1-c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 4/20 0.39
FABP4 P15090 4/20 0.39
KDM4E B2RXH2 2/20 0.38
PLA2G2A P14555 1/20 0.37
FNTA P49354 2/20 0.37
FNTB P49356 2/20 0.37
FABP5 Q01469 3/20 0.34
CYP2C9 P11712 3/20 0.34
MAT2A P31153 1/20 0.34
NPSR1 Q6W5P4 2/20 0.33
TRPC5 Q9UL62 1/20 0.32
RORC P51449 2/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C19 P33261 2/20 0.32
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
STAT3 P40763 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL7168166 0.89 RORC (0.38) FABP3FABP4PLA2G2AFNTAFNTB
SCHEMBL7093338 0.77 MAPT (0.38) FABP3FABP4KDM4EPLA2G2AFNTA
SCHEMBL7088398 0.76 FNTA (0.47) FABP3FABP4KDM4EPLA2G2AFNTA
SCHEMBL7094552 0.75 IDO1 (0.48) FABP3FABP4KDM4EPLA2G2AFNTA
SCHEMBL7191222 0.74 FNTA (0.45) FABP3FABP4FNTAFNTBFABP5
SCHEMBL7090215 0.70 FNTA (0.48) FNTAFNTBRORC
SCHEMBL7095009 0.70 KDM4E (0.34) FABP3FABP4KDM4EPLA2G2ACYP2C9
SCHEMBL7092809 0.70 MAPT (0.38) FABP3FABP4KDM4EPLA2G2AFNTA
SCHEMBL6987223 0.67 IDO1 (0.48) FABP3FABP4FNTAFNTBFABP5
SCHEMBL7093092 0.67 FNTA (0.44) FNTAFNTBRORC

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