SCHEMBL6869864

SCHEMBL6869864

COCCn1c(=O)cc(-c2cccc(Cl)c2)c2cc(C(O)c3ccc(Cl)cc3)ccc21

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.49
FNTB P49356 7/20 0.49
CNR1 P21554 3/20 0.43
TRPC5 Q9UL62 1/20 0.39
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PTGER4 P35408 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL6872833 0.89 FNTA (0.49) FNTAFNTBCNR1ALDH1A1CYP1A2
SCHEMBL6861981 0.83 ALDH1A1 (0.42) FNTAFNTBCNR1ALDH1A1CYP1A2
SCHEMBL4144550 0.82 FNTA (0.51) FNTAFNTBCNR1CYP1A2CYP3A4
Oxalic Acid SCHEMBL7701815 0.80 FNTA (0.49) FNTAFNTBCNR1CYP1A2CYP3A4
SCHEMBL6870737 0.76 FNTA (0.50) FNTAFNTBCNR1CYP3A4HSD17B10
SCHEMBL27251471 0.71 FNTA (0.66) FNTAFNTBCNR1CYP3A4HSD17B10
SCHEMBL14588476 0.71 FNTA (0.64) FNTAFNTBCYP3A4HSD17B10KMT2A
SCHEMBL6170916 0.71 FNTA (0.55) FNTAFNTBCNR1HSD17B10KMT2A
SCHEMBL6010160 0.69 FNTA (0.78) FNTAFNTBCYP3A4
SCHEMBL14588475 0.69 FNTA (0.62) FNTAFNTBCNR1CYP3A4HSD17B10

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1106610-B1 Farnesyl transferase inhibiting 2-quinolone derivatives JANSSEN PHARMACEUTICA NV (BE) 2004-06-16 EP disclosed
EP-1019395-B1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2002-01-30 EP disclosed
EP-1106610-A1 Farnesyl transferase inhibiting 2-quinolone derivatives Janssen Pharmaceutica N.V. (BE) 2001-06-13 EP disclosed
US-5968952-A ANTITUMOR AGENTS JANSSEN PHARMACEUTICA, N.V. (BE) 1999-10-19 US disclosed