Exemestane

Exemestane

SCHEMBL1781618

C=C1C[C@@H]2[C@@H](CC[C@]3(C)C(=O)CC[C@@H]23)[C@@]2(C)C=CC(=O)C=C12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CYP19A1

The experimentally established mechanism targets of Exemestane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 known ✓ P11511 18/20 1.00
KDM4E B2RXH2 1/20 1.00
ALDH1A1 P00352 1/20 1.00
ABCB11 O95342 1/20 1.00
NR3C1 P04150 1/20 1.00
PGR P06401 1/20 1.00
HTR2A P28223 1/20 1.00
OPRK1 P41145 1/20 1.00
HTR2B P41595 1/20 1.00
CYP3A4 P08684 1/20 0.62

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
Exemestane SCHEMBL178041 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
Exemestane SCHEMBL172893 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
Exemestane SCHEMBL2233503 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
Exemestane SCHEMBL19452231 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
Exemestane SCHEMBL6730580 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
Exemestane SCHEMBL13794245 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
Exemestane SCHEMBL6215 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
Exemestane SCHEMBL172860 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
Exemestane SCHEMBL21698489 1.00 CYP19A1 (1.00) CYP19A1KDM4EALDH1A1ABCB11NR3C1
SCHEMBL13301017 0.92 CYP19A1 (0.84) CYP19A1KDM4EALDH1A1ABCB11NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2070943-A1 Process for obtaining 6-Alkylidenandrost-1,4-diene-3one Crystal Pharma, S.A. (ES) 2009-06-17 EP claimed
EP-2556082-B1 SUBSTITUTED ANDROST-4-ENE DIONES UNIV EMORY (US) 2017-02-22 EP disclosed
US-20150148321-A1 SUBSTITUTED ANDROST-4-ENE DIONES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-28 US disclosed
US-8969327-B2 Substituted androst-4-ene diones EMORY UNIVERSITY (US) 2015-03-03 US disclosed
US-20130157988-A1 SUBSTITUTED ANDROST-4-ENE DIONES EMORY UNIVERSITY (US) 2013-06-20 US disclosed
EP-2556082-A2 SUBSTITUTED ANDROST-4-ENE DIONES Emory University (US) 2013-02-13 EP disclosed
US-8288571-B2 Process for preparing aromatiase inhibitor exemestane CADILA HEALTHCARE LIMITED (IN) 2012-10-16 US disclosed
WO-2010076811-A3 PROCESS FOR THE PREPARATION OF EXEMESTANE IND-SWIFT LABORATORIES LIMITED (IN) 2012-06-14 WO disclosed
US-20110118488-A1 PROCESS FOR OBTAINING 6-ALKYLIDENANDROST-1, 4-DIENE-3-ONE CRYSTAL PHARMA, S.A. (ES) 2011-05-19 US disclosed
US-20100311993-A1 PROCESS FOR PREPARING AROMATIASE INHIBITOR EXEMESTANE CADILA HEALTHCARE LIMITED (IN) 2010-12-09 US disclosed
EP-2070943-A1 Process for obtaining 6-Alkylidenandrost-1,4-diene-3one Crystal Pharma, S.A. (ES) 2009-06-17 EP disclosed
EP-1377298-B1 EXEMESTANE FOR TREATING HORMONO-DEPENDENT DISORDERS PFIZER ITALIA SRL (IT) 2006-08-30 EP disclosed
EP-1435967-A2 METHODS FOR PREVENTING AND TREATING BONE LOSS WITH STEROID COMPOUNDS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP disclosed
US-20040082557-A1 Methods for treating estrogen-dependent disorders PHARMACIA ITALIA S.P.A. (IT) 2004-04-29 US disclosed
US-20040024044-A1 Exemestane as chemopreventing agent PHARMACIA ITALIA S.P.A. (IT) 2004-02-05 US disclosed
EP-1377298-A2 COMBINED METHOD FOR TREATING HORMONO-DEPENDENT DISORDERS Pharmacia Italia S.p.A. (IT) 2004-01-07 EP disclosed
EP-1317270-A1 EXEMESTANE FOR THE TREATMENT OF OESTROGEN-DEPENDENT CANCERS Pharmacia Italia S.p.A. (IT) 2003-06-11 EP disclosed
WO-2003032961-A2 METHODS FOR PREVENTING AND TREATING BONE LOSS WITH STEROID COMPOUNDS PHARMACIA ITALIA SPA (IT) 2003-04-24 WO disclosed
WO-2002072106-A2 COMBINED METHOD FOR TREATING HORMONO-DEPENDENT DISORDERS WITH EXEMESTANE PHARMACIA ITALIA SPA (IT) 2002-09-19 WO disclosed
WO-2002020020-A1 EXEMESTANE AS CHEMOPREVENTING AGENT PHARMACIA ITALIA S.P.A. (IT) 2002-03-14 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 (5 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-20110118488-A1 PROCESS FOR OBTAINING 6-ALKYLIDENANDROST-1, 4-DIENE-3-ONE SRD5A1, SRD5A2, NR5A1 CYP19A1 6/4885KDM4E 2350/4885ALDH1A1 120/4885
US-20100311993-A1 PROCESS FOR PREPARING AROMATIASE INHIBITOR EXEMESTANE CYP19A1, POR, CYP17A1 CYP19A1 1/4885KDM4E 263/4885ALDH1A1 349/4885
US-20130157988-A1 SUBSTITUTED ANDROST-4-ENE DIONES HSD17B11, AR, NR5A1 CYP19A1 5/4885KDM4E 2222/4885ALDH1A1 756/4885
US-20150148321-A1 SUBSTITUTED ANDROST-4-ENE DIONES HSD17B11, AR, NR5A1 CYP19A1 5/4885KDM4E 2222/4885ALDH1A1 756/4885
US-20040082557-A1 Methods for treating estrogen-dependent disorders CYP19A1, BRCA1, ESR2 CYP19A1 1/4885KDM4E 738/4885ALDH1A1 630/4885

“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.