SCHEMBL2352111

SCHEMBL2352111

OC(Cc1ccc(F)cc1)(Cn1cncn1)Cn1cncn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.57
CYP3A4 P08684 7/20 0.55
CYP19A1 P11511 6/20 0.55
CYP2C9 P11712 5/20 0.55
CYP2C19 P33261 5/20 0.55
LMNA P02545 3/20 0.55
HSP90AA1 P07900 2/20 0.55
CYP11B1 P15538 1/20 0.55
CYP11B2 P19099 1/20 0.55
ADRA1A P35348 1/20 0.55
CYP51A1 Q16850 1/20 0.55
ALDH1A1 P00352 1/20 0.45
FDPS P14324 1/20 0.43
CYP2B6 P20813 1/20 0.41
CYP3A5 P20815 1/20 0.41
CYP3A7 P24462 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP3A43 Q9HB55 1/20 0.41
CYP46A1 Q9Y6A2 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL2351239 0.85 CYP3A4 (0.61) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL10334048 0.84 HSP90AA1 (0.62) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL10810029 0.81 HSP90AA1 (0.62) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL9661865 0.81 HSP90AA1 (0.58) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL10333452 0.80 CYP3A4 (0.64) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL9874872 0.79 KMT2A (0.48) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL9547001 0.79 KMT2A (0.51) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL10845813 0.78 KMT2A (0.53) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL9661013 0.78 KMT2A (0.86) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19
SCHEMBL10521049 0.78 CYP3A4 (0.54) KMT2ACYP3A4CYP19A1CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5583128-A ADMINISTERING A SIDE EFFECT REDUCED AROMATASE INHIBITOR CIBA-GEIGY CORPORATION (US) 1996-12-10 US claimed
EP-0250198-B1 BIS-AZOLYL COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-28 EP claimed
EP-0250198-A2 Bis-azolyl compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-12-23 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-7846957-B2 Aromatase inhibition to enhance assisted reproduction ARES TRADING S.A. (CH) 2010-12-07 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
EP-1898923-A4 AROMATASE INHIBITORS FOR EMERGENCY CONTRACEPTION CASPER ROBERT F (CA) 2009-05-20 EP disclosed
WO-2003082336-A1 FEMALE BIRTH CONTROL METHOD JENCAP RESEARCH LTD. (CA) 2003-10-09 WO disclosed
WO-2002083146-A1 MULTIPLE DOSE AROMATASE INHIBITOR FOR TREATING INFERTILITY ARES TRADING S.A. (CH) 2002-10-24 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
US-4933357-A 1,3-diazolyl-2-phenylalkyl-2-propanol derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-12 US disclosed
EP-0250198-B1 BIS-AZOLYL COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-28 EP disclosed
EP-0250198-A2 Bis-azolyl compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-12-23 EP 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-20100105640-A1 Aromatase Inhibitors for Emergency Contraception CYP19A1, SHBG, HSD17B11 KMT2A 1177/4885CYP3A4 32/4885CYP19A1 1/4885
US-12590950-B2 Methods for predicting ER-mediated DNA damage ESR1, ESR2, ESRRA KMT2A 491/4885CYP3A4 532/4885CYP19A1 7/4885

“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.