SCHEMBL7092407

SCHEMBL7092407

Fc1ccc(C(c2ccc3nc(Cl)cc(-c4ccccc4)c3c2)n2ccnc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.56
FNTB P49356 1/20 0.56
CYP19A1 P11511 13/20 0.54
CYP17A1 P05093 2/20 0.52
CYP3A4 P08684 2/20 0.51
CNR1 P21554 2/20 0.51
MEN1 O00255 1/20 0.51
NR1I2 O75469 1/20 0.51
USP2 O75604 1/20 0.51
ABCB11 O95342 1/20 0.51
ALDH1A1 P00352 1/20 0.51
PLA2G1B P04054 1/20 0.51
TP53 P04637 1/20 0.51
PGR P06401 1/20 0.51
HSP90AA1 P07900 1/20 0.51
MAPT P10636 1/20 0.51
IDO1 P14902 1/20 0.51
HPGD P15428 1/20 0.51
MAOA P21397 1/20 0.51
HTR2A P28223 1/20 0.51

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
SCHEMBL6310693 0.92 FNTA (0.67) FNTAFNTBCYP19A1CYP17A1CYP3A4
SCHEMBL6309676 0.79 CYP19A1 (0.44) FNTAFNTBCYP19A1CYP17A1CYP3A4
SCHEMBL6305490 0.78 FNTA (0.81) FNTAFNTBCYP19A1CYP17A1CYP3A4
SCHEMBL1683554 0.77 CYP19A1 (0.51) FNTAFNTBCYP19A1CYP17A1CYP3A4
SCHEMBL11827110 0.74 MAPK1 (0.47) MEN1ALDH1A1MAPTMAPK1KMT2A
SCHEMBL10642922 0.74 CYP19A1 (1.00) CYP19A1CYP17A1CYP3A4CNR1MEN1
Oxalic Acid SCHEMBL7668360 0.73 FNTA (0.48) FNTAFNTBCYP19A1CYP17A1CYP3A4
Oxalic Acid SCHEMBL7668363 0.73 FNTA (0.48) FNTAFNTBCYP19A1CYP17A1CYP3A4
SCHEMBL11643112 0.73 CYP17A1 (0.76) FNTAFNTBCYP19A1CYP17A1CYP3A4
SCHEMBL9664901 0.72 CYP19A1 (0.53) CYP19A1CYP17A1CYP3A4CNR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1178938-C 1,2-annelated quinoline derivatives ղɭҩҵ���޹�˾ 2004-12-08 CN disclosed
EP-1140935-B1 1,2-ANNELATED QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-05-14 EP disclosed
US-6458800-B1 1,2-annelated quinoline derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2002-10-01 US disclosed
CN-1331693-A 1,2-annelated quinoline derivatives JANSSEN PHARMACEUTICA NV (BE) 2002-01-16 CN disclosed
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