SCHEMBL6870078

SCHEMBL6870078

Cn1c(=O)cc(-c2cccc(Cl)c2)c2cccc(C(c3ccc(Cl)cc3)n3ccnc3)c21

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 9/20 0.50
FNTA P49354 8/20 0.49
FNTB P49356 8/20 0.49
CYP1A2 P05177 3/20 0.45
CYP3A4 P08684 3/20 0.45
CYP2D6 P10635 3/20 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
SCHEMBL6868055 0.84 FNTA (0.63) CYP19A1FNTAFNTBCYP1A2CYP3A4
SCHEMBL6870980 0.81 FNTA (0.60) CYP19A1FNTAFNTBCYP1A2CYP3A4
SCHEMBL5164053 0.78 FNTA (0.46) CYP19A1FNTAFNTBCYP1A2CYP3A4
SCHEMBL6867606 0.76 FNTA (0.67) CYP19A1FNTAFNTBCYP1A2CYP3A4
SCHEMBL4144550 0.75 FNTA (0.51) CYP19A1FNTAFNTBCYP1A2CYP3A4
SCHEMBL7210122 0.74 FNTA (0.54) CYP19A1FNTAFNTBCYP1A2CYP3A4
SCHEMBL6169572 0.74 FNTA (0.53) CYP19A1FNTAFNTB
SCHEMBL4156125 0.74 FNTA (0.85) CYP19A1FNTAFNTBCYP1A2CYP3A4
SCHEMBL3521134 0.74 FNTA (0.56) CYP19A1FNTAFNTBCYP1A2CYP3A4
SCHEMBL6871485 0.73 FNTA (0.51) FNTAFNTBCYP3A4

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-1106610-B1 Farnesyl transferase inhibiting 2-quinolone derivatives JANSSEN PHARMACEUTICA NV (BE) 2004-06-16 EP claimed
EP-1019395-B1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2002-01-30 EP claimed