SCHEMBL1683554

SCHEMBL1683554

Fc1ccc(C(c2ccc3c(c2)c(-c2ccccc2)cc2nccn23)n2ccnc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 13/20 0.51
FNTA P49354 1/20 0.49
FNTB P49356 1/20 0.49
CYP17A1 P05093 3/20 0.49
MEN1 O00255 1/20 0.48
NR1I2 O75469 1/20 0.48
USP2 O75604 1/20 0.48
ABCB11 O95342 1/20 0.48
ALDH1A1 P00352 1/20 0.48
PLA2G1B P04054 1/20 0.48
TP53 P04637 1/20 0.48
PGR P06401 1/20 0.48
HSP90AA1 P07900 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
IDO1 P14902 1/20 0.48
HPGD P15428 1/20 0.48
MAOA P21397 1/20 0.48
CNR1 P21554 1/20 0.48
HTR2A P28223 1/20 0.48

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 SCHEMBL7668360 0.95 FNTA (0.48) CYP19A1FNTAFNTBCYP17A1MEN1
Oxalic Acid SCHEMBL7668363 0.95 FNTA (0.48) CYP19A1FNTAFNTBCYP17A1MEN1
SCHEMBL7092407 0.77 FNTA (0.56) CYP19A1FNTAFNTBCYP17A1MEN1
SCHEMBL6305490 0.76 FNTA (0.81) CYP19A1FNTAFNTBCYP17A1MEN1
SCHEMBL10642922 0.71 CYP19A1 (1.00) CYP19A1CYP17A1MEN1NR1I2USP2
SCHEMBL3525316 0.71 FNTA (0.47) FNTAFNTBCYP3A4MAPT
SCHEMBL6867606 0.71 FNTA (0.67) CYP19A1FNTAFNTBCYP17A1MEN1
SCHEMBL6309676 0.69 CYP19A1 (0.44) CYP19A1FNTAFNTBCYP17A1MEN1
SCHEMBL6866443 0.69 FNTA (0.88) CYP19A1FNTAFNTBCYP17A1MEN1
SCHEMBL11349905 0.69 CYP17A1 (1.00) CYP19A1CYP17A1MEN1NR1I2USP2

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 96 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4725940-B2 2011-07-13 JP claimed
EP-2155197-A2 TREATMENT OF LYSOSOMAL STORAGE DISEASES Link Medicine Corporation (US) 2010-02-24 EP claimed
EP-1809265-A4 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES BRIGHAM & WOMENS HOSPITAL (US) 2009-06-17 EP claimed
WO-2008112525-A2 TREATMENT OF LYSOSOMAL STORAGE DISEASES LINK MEDICINE CORPORATION (US) 2008-09-18 WO 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
US-20030119843-A1 1,2-annelated quinoline derivatives JANSSEN PHARMACEUTICA, N.V. 2003-06-26 US claimed
EP-1140935-B1 1,2-ANNELATED QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-05-14 EP claimed
US-6458800-B1 1,2-annelated quinoline derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2002-10-01 US claimed
EP-1140935-A2 1,2-ANNELATED QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2001-10-10 EP claimed
WO-2000039082-A2 1,2-ANNELATED QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2000-07-06 WO claimed
US-8557847-B2 Synergistic modulation of FLT3 kinase using a FLT3 inhibitor and a farnesyl transferase inhibitor JANSSEN PHARMACEUTICA, N.V. (BE) 2013-10-15 US disclosed
EP-1815247-B1 THERAPEUTIC USE OF FARNESYLTRANSFERASE INHIBITORS AND METHODS OF MONITORING THE EFFICACY THEREOF JANSSEN PHARMACEUTICA NV (BE) 2013-02-20 EP disclosed
US-20120196766-A1 Therapeutic Use of Farnesyltransferase Inhibitors and Methods of Monitoring the Efficacy Thereof FOURIE ANNE MADELEINE (US) 2012-08-02 US disclosed
US-20120108634-A1 FARNESYL PROTEIN TRANSFERASE INHIBITOR COMBINATIONS WITH ANTIESTROGEN AGENTS END DAVID WILLIAM (US) 2012-05-03 US disclosed
WO-2001064199-A2 FARNESYL PROTEIN TRANSFERASE INHIBITOR COMBINATIONS WITH TAXANE COMPOUNDS JANSSEN PHARMACEUTICA N.V. (BE) 2001-09-07 WO disclosed
WO-2001064195-A2 FARNESYL PROTEIN TRANSFERASE INHIBITOR COMBINATIONS WITH ANTI-TUMOR NUCLEOSIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2001-09-07 WO disclosed
WO-2001064218-A2 FARNESYL PROTEIN TRANSFERASE INHIBITOR COMBINATIONS JANSSEN PHARMACEUTICA N.V. (BE) 2001-09-07 WO disclosed
WO-2001056552-A2 FARNESYL PROTEIN TRANSFERASE INHIBITORS FOR TREATING BREAST CANCER JANSSEN PHARMACEUTICA N.V. (BE) 2001-08-09 WO disclosed
WO-2000039082-A2 1,2-ANNELATED QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2000-07-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120108634-A1 FARNESYL PROTEIN TRANSFERASE INHIBITOR COMBINATIONS WITH ANTIESTROGEN AGENTS FNTA, FNTB, PTAR1 CYP19A1 31/4885FNTA 1/4885FNTB 2/4885
US-20030119843-A1 1,2-annelated quinoline derivatives NAT1, CYP7A1, CYP4A11 CYP19A1 549/4885FNTA 19/4885FNTB 27/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.