Abiraterone

Abiraterone

SCHEMBL13735874

CC12CC[C@H]3[C@H](CC=C4C[C@@H](O)CCC43C)[C@H]1CC=C2c1cccnc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ARCYP17A1SRD5A1SRD5A2SRD5A3

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

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP17A1 known ✓ P05093 16/20 1.00
▸ AR known ✓ P10275 1/20 0.71
▸ CYP21A2 P08686 6/20 1.00
▸ CYP11B1 P15538 2/20 1.00
▸ CYP3A4 P08684 1/20 1.00
▸ CYP11B2 P19099 1/20 1.00
▸ CDK8 P49336 3/20 0.72
▸ PGR P06401 1/20 0.71

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
Abiraterone SCHEMBL15700283 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL16439307 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL16383633 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL16381720 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL23924960 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL17384662 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL25074918 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL17384634 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL22414103 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2
Abiraterone SCHEMBL19724576 1.00 CYP17A1 (1.00) CYP17A1CYP21A2CYP11B1CYP3A4CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3890749-B1 CDK9 INHIBITORS AND POLYMORPHS THEREOF FOR USE AS AGENTS FOR TREATMENT OF CANCER SUMITOMO PHARMA AMERICA INC (US) 2025-10-29 — — EP disclosed
US-20250197432-A1 CDK9 Inhibitors and Polymorphs Thereof For Use As Agents For Treatment of Cancer SUMITOMO PHARMA ONCOLOGY INC (US) 2025-06-19 — — US disclosed
US-20250100986-A1 BISPHENOL DERIVATIVES AND THEIR USE AS ANDROGEN RECEPTOR ACTIVITY MODULATORS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2025-03-27 — — US disclosed
US-20240391883-A1 HETEROCYCLIC COMPOUNDS FOR CANCER IMAGING AND TREATMENT AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2024-11-28 — — US disclosed
EP-4446301-A2 HETEROCYCLIC COMPOUNDS FOR CANCER IMAGING AND TREATMENT AND METHODS FOR THEIR USE British Columbia Cancer Agency Branch (CA) 2024-10-16 — — EP disclosed
US-12077554-B2 CDK9 inhibitors and polymorphs thereof for use as agents for treatment of cancer SUMITOMO PHARMA ONCOLOGY, INC. (US) 2024-09-03 — — US disclosed
EP-3988541-B1 HETEROCYCLIC COMPOUNDS FOR CANCER IMAGING AND TREATMENT AND METHODS FOR THEIR USE BRITISH COLUMBIA CANCER AGENCY BRANCH (CA) 2024-06-26 — — EP disclosed
US-11919874-B2 Bisphenol derivatives and their use as androgen receptor activity modulators THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2024-03-05 — — US disclosed
EP-3442942-B1 BISPHENOL DERIVATIVES AND THEIR USE AS ANDROGEN RECEPTOR ACTIVITY MODULATORS BRITISH COLUMBIA CANCER AGENCY BRANCH (CA) 2023-11-15 — — EP disclosed
US-11779550-B2 Bisphenol ether derivatives and methods for using the same THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2023-10-10 — — US disclosed
EP-2744773-B1 FLUORINATED BISPHENOL ETHER COMPOUNDS AND METHODS FOR THEIR USE BRITISH COLUMBIA CANCER AGENCY (CA) 2016-11-02 — — EP disclosed
US-9365510-B2 Aziridine bisphenol ethers and related compounds and methods for their use BRITISH COLUMBIA CANCER AGENCY BRANCH (CA) 2016-06-14 — — US disclosed
US-20150010469-A1 BISPHENOL ETHER COMPOUNDS WITH NOVEL BRIDGING GROUPS AND METHODS FOR THEIR USE BRITISH COLUMBIA CANCER AGENCY BRANCH (CA) 2015-01-08 — — US disclosed
US-20140248263-A1 BISPHENOL COMPOUNDS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2014-09-04 — — US disclosed
EP-2744773-A1 FLUORINATED BISPHENOL ETHER COMPOUNDS AND METHODS FOR THEIR USE British Columbia Cancer Agency Branch (CA) 2014-06-25 — — EP disclosed
US-20130336962-A1 AZIRIDINE BISPHENOL ETHERS AND RELATED COMPOUNDS AND METHODS FOR THEIR USE The University of Biritish Columbia (CA) 2013-12-19 — — US disclosed
WO-2013028572-A1 FLUORINATED BISPHENOL ETHER COMPOUNDS AND METHODS FOR THEIR USE BRITISH COLUMBIA CANCER AGENCY BRANCH (CA) 2013-02-28 — — WO disclosed
US-20130045204-A1 FLUORINATED BISPHENOL ETHER COMPOUNDS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2013-02-21 — — US disclosed
WO-2012145330-A1 FLUORENE-9-BISPHENOL COMPOUNDS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-10-26 — — WO disclosed
WO-2012145328-A1 DIBENZYLPHENYL COMPOUNDS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-10-26 — — 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 (10 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-20250100986-A1 BISPHENOL DERIVATIVES AND THEIR USE AS ANDROGEN RECEPTOR ACTIVITY MODULATORS AR, SHBG, NR5A1 CYP17A1 13/4885AR 1/4885CYP21A2 46/4885
US-20240391883-A1 HETEROCYCLIC COMPOUNDS FOR CANCER IMAGING AND TREATMENT AND METHODS FOR THEIR USE AR, KLK3, GNRHR CYP17A1 23/4885AR 1/4885CYP21A2 86/4885
US-20130336962-A1 AZIRIDINE BISPHENOL ETHERS AND RELATED COMPOUNDS AND METHODS FOR THEIR USE ESR1, AR, ESR2 CYP17A1 784/4885AR 2/4885CYP21A2 476/4885
US-20130045204-A1 FLUORINATED BISPHENOL ETHER COMPOUNDS AND METHODS FOR THEIR USE AR, ESRRA, ESR1 CYP17A1 208/4885AR 1/4885CYP21A2 180/4885
US-20150010469-A1 BISPHENOL ETHER COMPOUNDS WITH NOVEL BRIDGING GROUPS AND METHODS FOR THEIR USE AR, ESR2, ESR1 CYP17A1 99/4885AR 1/4885CYP21A2 91/4885
US-11919874-B2 Bisphenol derivatives and their use as androgen receptor activity modulators AR, SHBG, NR5A1 CYP17A1 13/4885AR 1/4885CYP21A2 46/4885
US-20140248263-A1 BISPHENOL COMPOUNDS AND METHODS FOR THEIR USE AR, SHBG, ESRRA CYP17A1 90/4885AR 1/4885CYP21A2 113/4885
US-11779550-B2 Bisphenol ether derivatives and methods for using the same AR, SHBG, ESRRA CYP17A1 21/4885AR 1/4885CYP21A2 25/4885
US-20250197432-A1 CDK9 Inhibitors and Polymorphs Thereof For Use As Agents For Treatment of Cancer CDK9, CDK19, CDK7 CYP17A1 3103/4885AR 2470/4885CYP21A2 2838/4885
US-12077554-B2 CDK9 inhibitors and polymorphs thereof for use as agents for treatment of cancer CDK9, CDK19, CDK7 CYP17A1 3103/4885AR 2470/4885CYP21A2 2838/4885

“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.

Send feedback