Tretinoin

Tretinoin

SCHEMBL8399912

CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)O)C(C)(C)CCC1.CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)O)C(C)(C)CCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

RARARARBRARG

The experimentally established mechanism targets of Tretinoin. 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
RARA known ✓ P10276 4/20 1.00
RARB known ✓ P10826 4/20 1.00
RARG known ✓ P13631 4/20 1.00
ALDH1A1 P00352 12/20 1.00
MAPT P10636 9/20 1.00
CYP3A4 P08684 6/20 1.00
RXRA P19793 5/20 1.00
PTGS1 P23219 4/20 1.00
APP P05067 4/20 1.00
SNCA P37840 4/20 1.00
MAPK1 P28482 3/20 1.00
ALOX15 P16050 3/20 1.00
RXRB P28702 2/20 1.00
RXRG P48443 2/20 1.00
RORC P51449 2/20 1.00
ADORA3 P0DMS8 2/20 1.00
HTR2B P41595 2/20 1.00
BLM P54132 2/20 1.00
HIF1A Q16665 2/20 1.00
DRD3 P35462 2/20 1.00

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
Tretinoin SCHEMBL3146 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Isotretinoin SCHEMBL9123793 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Tretinoin SCHEMBL7846921 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Tretinoin SCHEMBL24982760 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Isotretinoin SCHEMBL38299 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Tretinoin SCHEMBL24982761 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Alitretinoin SCHEMBL5331051 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Tretinoin SCHEMBL18667 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Isotretinoin SCHEMBL20603086 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA
Tretinoin SCHEMBL445176 1.00 ALDH1A1 (1.00) ALDH1A1MAPTCYP3A4RXRARARA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3675838-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS Puretecch LYT, Inc. (US) 2020-07-08 EP disclosed
WO-2019046491-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS ARIYA THERAPEUTICS, INC. (US) 2019-03-07 WO disclosed
US-5885596-A Methods and compositions for fine lines and/or wrinkles BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-23 US disclosed
US-5034228-A Skin cream with carrier, lipids or liposomes and retinoids MOET-HENNESSY RECHERCHE (FR) 1991-07-23 US disclosed
US-4727088-A Retinoid composition having enhanced bioavailability and percutaneous absorption NEUTROGENA CORPORATION (US) 1988-02-23 US disclosed