SCHEMBL4144550

SCHEMBL4144550

COCCn1c(=O)cc(-c2cccc(Cl)c2)c2cc(C(c3ccc(Cl)cc3)n3ccnc3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 8/20 0.51
FNTB P49356 8/20 0.51
CYP19A1 P11511 6/20 0.46
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CNR1 P21554 3/20 0.43

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
Oxalic Acid SCHEMBL7701815 0.96 FNTA (0.49) FNTAFNTBCYP19A1CYP1A2CYP3A4
SCHEMBL6868055 0.86 FNTA (0.63) FNTAFNTBCYP19A1CYP1A2CYP3A4
SCHEMBL6872833 0.82 FNTA (0.49) FNTAFNTBCYP1A2CYP3A4CNR1
SCHEMBL6869864 0.82 FNTA (0.49) FNTAFNTBCYP1A2CYP3A4CNR1
SCHEMBL8473920 0.80 FNTA (0.50) FNTAFNTBCYP19A1CYP1A2CYP3A4
SCHEMBL6867606 0.79 FNTA (0.67) FNTAFNTBCYP19A1CYP1A2CYP3A4
SCHEMBL6869798 0.79 FNTA (0.61) FNTAFNTBCYP19A1CYP1A2CYP3A4
SCHEMBL6861981 0.75 ALDH1A1 (0.42) FNTAFNTBCYP1A2CYP3A4CNR1
SCHEMBL4156125 0.75 FNTA (0.85) FNTAFNTBCYP19A1CYP1A2CYP3A4
SCHEMBL6169572 0.75 FNTA (0.53) FNTAFNTBCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1809265-A4 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES BRIGHAM & WOMENS HOSPITAL (US) 2009-06-17 EP claimed
EP-1809265-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2007-07-25 EP claimed
WO-2005089504-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2005-09-29 WO claimed
EP-1106610-B1 Farnesyl transferase inhibiting 2-quinolone derivatives JANSSEN PHARMACEUTICA NV (BE) 2004-06-16 EP claimed
CN-1101391-C Farnesyl transferase inhibiting 2-quinolone derivatives JANSSEN PHARMACEUTICA NV (BE) 2003-02-12 CN claimed
EP-1019395-B1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2002-01-30 EP claimed
EP-1106610-A1 Farnesyl transferase inhibiting 2-quinolone derivatives Janssen Pharmaceutica N.V. (BE) 2001-06-13 EP claimed
US-5968952-A ANTITUMOR AGENTS JANSSEN PHARMACEUTICA, N.V. (BE) 1999-10-19 US claimed
CN-1200732-A Farnesyl transferase inhibiting 2-quinolone derivatives JANSSEN PHARMACEUTICA NV (BE) 1998-12-02 CN claimed
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
EP-1019395-A1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2000-07-19 EP disclosed
US-5968952-A ANTITUMOR AGENTS JANSSEN PHARMACEUTICA, N.V. (BE) 1999-10-19 US disclosed
WO-1997016443-A1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1997-05-09 WO disclosed