Acitretin

Acitretin

SCHEMBL2280089

COc1cc(C)c(C=CC(C)=CC=CC(C)=CC(=O)O)c(C)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

RARARARBRARGRXRARXRBRXRG

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA known ✓ P19793 12/20 0.45
RARG known ✓ P13631 9/20 0.45
RARA known ✓ P10276 6/20 0.45
RARB known ✓ P10826 6/20 0.45
RXRB known ✓ P28702 4/20 0.45
RXRG known ✓ P48443 4/20 0.45
ALDH1A1 P00352 8/20 1.00
MAPT P10636 7/20 1.00
SMN1; SMN2 Q16637 4/20 1.00
ABCB11 O95342 2/20 1.00
ABCC4 O15439 1/20 1.00
NR1I2 O75469 1/20 1.00
PTGS1 P23219 4/20 0.72
ADORA3 P0DMS8 3/20 0.72
PGR P06401 2/20 0.72
CHRM1 P11229 2/20 0.72
SLC6A2 P23975 2/20 0.72
ESR1 P03372 1/20 0.72
SLC6A4 P31645 1/20 0.72
OPRM1 P35372 1/20 0.72

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
Acitretin SCHEMBL159360 1.00 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
Acitretin SCHEMBL29883491 1.00 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
Acitretin SCHEMBL5028866 1.00 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
Acitretin SCHEMBL29496318 1.00 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
Acitretin SCHEMBL3759 1.00 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
Acitretin SCHEMBL5053805 1.00 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
Acitretin SCHEMBL10750446 0.99 ALDH1A1 (0.98) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
Acitretin SCHEMBL4443721 0.99 ALDH1A1 (0.98) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
Acitretin SCHEMBL9856594 0.94 ALDH1A1 (0.89) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4
SCHEMBL10750080 0.94 ALDH1A1 (0.89) ALDH1A1MAPTSMN1; SMN2ABCB11ABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2703407-B1 METHOD FOR MANUFACTURING PHOSPHONOCROTONIC ACID DERIVATIVE KOWA CO (JP) 2017-07-26 EP claimed
US-9540301-B2 Method for manufacturing phosphonocrotonic acid derivative KOWA COMPANY, LTD. (JP) 2017-01-10 US claimed
US-20140249117-A1 ACTIVE INGREDIENT COMBINATION OF A RETINOID AND A HORMONE COMBINATION WITH CONTRACEPTIVE ACTION AS MEDICAMENT FOR TREATMENT OF SKIN DISEASES RICHTER GEDEON NYRT. (HU) 2014-09-04 US claimed
EP-2703407-A1 METHOD FOR MANUFACTURING PHOSPHONOCROTONIC ACID DERIVATIVE Kowa Company, Ltd. (JP) 2014-03-05 EP claimed
US-20140051876-A1 METHOD FOR MANUFACTURING PHOSPHONOCROTONIC ACID DERIVATIVE MANAC INCORPORATED (JP) 2014-02-20 US claimed
EP-2124924-B1 Active ingredient combination of a retinoid and a hormone combination with contraceptive action as medicament for treatment of skin diseases GRUENENTHAL GMBH (DE) 2012-06-27 EP claimed
US-20090312296-A1 ACTIVE INGREDIENT COMBINATION OF A RETINOID AND A HORMONE COMBINATION WITH CONTRACEPTIVE ACTION AS MEDICAMENT FOR TREATMENT OF SKIN DISEASES GRUNENTHAL GMBH (DE) 2009-12-17 US claimed
EP-2124924-A1 ACTIVE INGREDIENT COMBINATION OF A RETINOID AND A HORMONE COMBINATION WITH CONTRACEPTIVE ACTION AS MEDICAMENT FOR TREATMENT OF SKIN DISEASES Grünenthal GmbH (DE) 2009-12-02 EP claimed
WO-2008077541-A1 ACTIVE INGREDIENT COMBINATION OF A RETINOID AND A HORMONE COMBINATION WITH CONTRACEPTIVE ACTION AS MEDICAMENT FOR TREATMENT OF SKIN DISEASES Grünenthal GmbH (DE) 2008-07-03 WO claimed
EP-0327263-B1 Hair growth stimulation with nitroxide and other radicals PROCTOR PETER H (US) 1994-09-07 EP claimed
WO-1988005653-A1 TOPICAL COMPOSITION FOR STIMULATING HAIR GROWTH WITH STABLE FREE RADICALS PROCTOR PETER H (US) 1988-08-11 WO claimed
EP-0002533-B1 USE OF RETINOIDS AS MEDICINES F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-06-25 EP claimed
US-4215215-A 9-Phenyl-nonate traene compounds HOFFMANN-LA ROCHE INC. (US) 1980-07-29 US claimed
US-4105681-A ANTITUMOR AGENTS HOFFMANN-LA ROCHE INC. (US) 1978-08-08 US claimed
US-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2023-11-16 US disclosed
CN-116334113-A Conditionally active heterodimeric polypeptides and methods of use thereof 加利福尼亚大学董事会 2023-06-27 CN disclosed
US-11672800-B2 Combination therapies with EHMT2 inhibitors Epizyme, Inc. (US) 2023-06-13 US disclosed
EP-0002533-A2 Use of retinoids as medicines F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1979-06-27 EP disclosed
US-4105681-A ANTITUMOR AGENTS HOFFMANN-LA ROCHE INC. (US) 1978-08-08 US disclosed
US-4021574-A Antidandruff compositions containing 9-(4-lower alkoxy-2,3,6-trilower-alkylphenyl)-3,7-dimethyl-nona-2,4,6,8-tetraen-1-oic acid lower alkyl amides HOFFMANN-LA ROCHE INC. (US) 1977-05-03 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-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 RXRA 2611/4885RARG 1312/4885RARA 2373/4885
US-20140051876-A1 METHOD FOR MANUFACTURING PHOSPHONOCROTONIC ACID DERIVATIVE C1S, C3AR1, C9 RXRA 1711/4885RARG 2703/4885RARA 1727/4885
US-11672800-B2 Combination therapies with EHMT2 inhibitors EHMT2, BHMT, SHMT2 RXRA 2611/4885RARG 1312/4885RARA 2373/4885

“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.