SCHEMBL2352944

SCHEMBL2352944

Cc1oc2c(C(N)=O)ccc(Cn3ccnc3)c2c1C

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 16/20 0.62
TBXAS1 P24557 2/20 0.47
CYP11B1 P15538 12/20 0.43
CYP11B2 P19099 12/20 0.43
CYP17A1 P05093 10/20 0.43
ATM Q13315 1/20 0.40

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
Hydrochloric Acid SCHEMBL9844004 0.99 CYP19A1 (0.61) CYP19A1TBXAS1CYP11B1CYP11B2CYP17A1
SCHEMBL9843746 0.84 CYP19A1 (0.57) CYP19A1TBXAS1CYP11B1CYP11B2CYP17A1
SCHEMBL9843743 0.83 CYP19A1 (0.56) CYP19A1TBXAS1CYP11B1CYP11B2CYP17A1
SCHEMBL7573772 0.81 TBXAS1 (0.46) CYP19A1TBXAS1CYP11B1CYP11B2ATM
SCHEMBL8869750 0.80 CYP19A1 (0.69) CYP19A1CYP11B1CYP11B2CYP17A1
SCHEMBL2352579 0.79 CYP19A1 (0.52) CYP19A1TBXAS1CYP11B1CYP11B2CYP17A1
SCHEMBL2355216 0.77 CYP19A1 (1.00) CYP19A1CYP11B1CYP11B2CYP17A1
Hydrochloric Acid SCHEMBL9844041 0.76 CYP19A1 (0.98) CYP19A1CYP11B1CYP11B2CYP17A1
Hydrochloric Acid SCHEMBL9843801 0.73 CYP19A1 (0.59) CYP19A1TBXAS1CYP11B1CYP11B2CYP17A1
SCHEMBL2352950 0.70 PARP1 (0.38) CYP19A1TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0445073-A1 Benzofurans CIBA-GEIGY AG (CH) 1991-09-04 EP claimed
US-12590950-B2 Methods for predicting ER-mediated DNA damage UNIVERSITY OF MASSACHUSETTS (US) 2026-03-31 US disclosed
US-20210109085-A1 METHODS FOR PREDICTING ER-MEDIATED DNA DAMAGE UNIVERSITY OF MASSACHUSETTS 2021-04-15 US disclosed
US-8871750-B2 Use of aromatase inhibitors for endometrial thinning in preparation for surgical procedures on the endometrial cavity and uterus WAYNE STATE UNIVERSITY (US) 2014-10-28 US disclosed
US-8008333-B2 Inducing ovulation; increasing response to follicle stimulating hormone ARES TRADING S.A. (CH) 2011-08-30 US disclosed
US-7820706-B2 Multiple dose aromatase inhibitor for treating infertility ARES TRADING S.A. (CH) 2010-10-26 US disclosed
US-20100105640-A1 Aromatase Inhibitors for Emergency Contraception CASPER ROBERT F 2010-04-29 US disclosed
CN-100593401-C Combination of an aromatase inhibitor with a bisphosphonate NOVARTIS AG 2010-03-10 CN disclosed
EP-1898923-A4 AROMATASE INHIBITORS FOR EMERGENCY CONTRACEPTION CASPER ROBERT F (CA) 2009-05-20 EP disclosed
EP-1898923-A1 AROMATASE INHIBITORS FOR EMERGENCY CONTRACEPTION Casper, Robert F. (CA) 2008-03-19 EP disclosed
US-20040171660-A1 Single dose aromatase inhibitor for treating infertility ARES TRADINS S.A. (CH) 2004-09-02 US disclosed
WO-2002083240-A9 AROMATASE INHIBITION TO ENHANCE ASSISTED REPRODUCTION ARES TRADING SA (CH) 2004-05-06 WO disclosed
WO-2004012728-A1 COMBINATION OF AN AROMATASE INHIBITOR WITH A BISPHOSPHONATE NOVARTIS AG (CH) 2004-02-12 WO disclosed
EP-1383578-A1 SINGLE DOSE AROMATASE INHIBITOR FOR TREATING INFERTILITY ARES TRADING S.A. (CH) 2004-01-28 EP disclosed
EP-1381431-A1 AROMATASE INHIBITION TO ENHANCE ASSISTED REPRODUCTION ARES TRADING S.A. (CH) 2004-01-21 EP disclosed
WO-2003082336-A1 FEMALE BIRTH CONTROL METHOD JENCAP RESEARCH LTD. (CA) 2003-10-09 WO disclosed
WO-2002083241-A1 SINGLE DOSE AROMATASE INHIBITOR FOR TREATING INFERTILITY ARES TRADING S.A. (CH) 2002-10-24 WO disclosed
WO-2002083239-A1 AROMATASE INHIBITORS FOR TREATING INFERTILITY ARES TRADING S.A. (CH) 2002-10-24 WO disclosed
WO-2002083240-A1 AROMATASE INHIBITION TO ENHANCE ASSISTED REPRODUCTION ARES TRADING S.A. (CH) 2002-10-24 WO disclosed
US-5583128-A ADMINISTERING A SIDE EFFECT REDUCED AROMATASE INHIBITOR CIBA-GEIGY CORPORATION (US) 1996-12-10 US 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 (3 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-20100105640-A1 Aromatase Inhibitors for Emergency Contraception CYP19A1, SHBG, HSD17B11 CYP19A1 1/4885TBXAS1 127/4885CYP11B1 20/4885
US-12590950-B2 Methods for predicting ER-mediated DNA damage ESR1, ESR2, ESRRA CYP19A1 7/4885TBXAS1 1301/4885CYP11B1 525/4885
US-20040171660-A1 Single dose aromatase inhibitor for treating infertility CYP19A1, FSHR, SHBG CYP19A1 1/4885TBXAS1 1642/4885CYP11B1 56/4885

“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.