Arotinoid

Arotinoid

SCHEMBL2890175

CCOC(=O)c1ccc(/C=C(\C)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARG P13631 19/20 0.70
RARB P10826 18/20 0.70
RARA P10276 17/20 0.70
RXRA P19793 10/20 0.70
KDM4E B2RXH2 1/20 0.70
NPC1 O15118 1/20 0.70
CYP26A1 O43174 1/20 0.70
GMNN O75496 1/20 0.70
USP2 O75604 1/20 0.70
ALDH1A1 P00352 1/20 0.70
LMNA P02545 1/20 0.70
TP53 P04637 1/20 0.70
CYP1A2 P05177 1/20 0.70
POLB P06746 1/20 0.70
CYP3A4 P08684 1/20 0.70
CYP2D6 P10635 1/20 0.70
NFKB1 P19838 1/20 0.70
CYP2C19 P33261 1/20 0.70
THPO P40225 1/20 0.70
MTOR P42345 1/20 0.70

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
Arotinoid SCHEMBL2890176 1.00 RARG (0.70) RARGRARBRARARXRAKDM4E
Arotinoid SCHEMBL29430179 1.00 RARG (0.70) RARGRARBRARARXRAKDM4E
SCHEMBL9419002 0.95 RARG (0.63) RARGRARBRARARXRAKDM4E
SCHEMBL9419006 0.95 RARG (0.63) RARGRARBRARARXRAKDM4E
SCHEMBL7547905 0.93 RARB (0.59) RARGRARBRARARXRAKDM4E
SCHEMBL7547910 0.93 RARB (0.59) RARGRARBRARARXRAKDM4E
SCHEMBL7087173 0.89 RARG (0.61) RARGRARBRARARXRAKDM4E
SCHEMBL7087175 0.89 RARG (0.61) RARGRARBRARARXRAKDM4E
SCHEMBL7085857 0.88 RARG (0.67) RARGRARBRARARXRAKDM4E
SCHEMBL7085861 0.88 RARG (0.67) RARGRARBRARARXRAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4326055-A ANTITUMOR AGENTS, SKIN DISORDERS, RHEUMATIC DISEASES HOFFMANN-LA ROCHE INC. (US) 1982-04-20 US claimed
EP-3152190-B1 18-20 MEMBER BI-POLYCYCLIC COMPOUNDS HARO PHARMACEUTICAL INC (US) 2024-07-31 EP disclosed
US-10954194-B2 18-20 member bi-polycyclic compounds Haro Pharmaceuticals Inc. (US) 2021-03-23 US disclosed
US-10954194-B2 18-20 member bi-polycyclic compounds Haro Pharmaceuticals Inc. (US) 2021-03-23 US disclosed
US-10752591-B2 18-20 member bi-polycyclic compounds Haro Pharmaceuticals Inc. (US) 2020-08-25 US disclosed
US-10377715-B2 18-20 member bi-polycyclic compounds Haro Pharmaceuticals Inc. (US) 2019-08-13 US disclosed
US-10377715-B2 18-20 member bi-polycyclic compounds Haro Pharmaceuticals Inc. (US) 2019-08-13 US disclosed
US-20180362467-A1 18-20 MEMBER BI-POLYCYCLIC COMPOUNDS HARO PHARMACEUTICAL INC. 2018-12-20 US disclosed
US-20170114019-A1 18-20 MEMBER BI-POLYCYCLIC COMPOUNDS HARO PHARMACEUTICAL INC. 2017-04-27 US disclosed
US-20170114019-A1 18-20 MEMBER BI-POLYCYCLIC COMPOUNDS HARO PHARMACEUTICAL INC. 2017-04-27 US disclosed
WO-2002032413-A2 A METHOD TO INCORPORATE N-(4-HYDROXYPHENYL) RETINAMIDE IN LIPOSOMES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2002-04-25 WO disclosed
WO-1995033745-A9 NOVEL COMPOUNDS USEFUL IN MODULATING GENE EXPRESSION OF RETINOID RESPONSIVE GENES AND/OR HAVING ANTI-AP-1 ACTIVITY 1996-01-18 WO disclosed
EP-0510066-A4 1-AZETIDYL AND 1-HEXAMETHYLENIMINE ALKYL OR ARYL BISPHOSPHONIC ACIDS AND THEIR USE AS PHARMACOLOGICAL AGENTS 1992-12-02 EP disclosed
EP-0510066-A1 1-AZETIDYL AND 1-HEXAMETHYLENIMINE ALKYL OR ARYL BISPHOSPHONIC ACIDS AND THEIR USE AS PHARMACOLOGICAL AGENTS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-10-28 EP disclosed
WO-1991010646-A1 1-AZETIDYL AND 1-HEXAMETHYLENIMINE ALKYL OR ARYL BISPHOSPHONIC ACIDS AND THEIR USE AS PHARMACOLOGICAL AGENTS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1991-07-25 WO disclosed
US-4942157-A CALCIUM METABOLISM, BONE DISORDERS BOEHRINGER MANNHEIM GMBH (DE) 1990-07-17 US disclosed
EP-0155940-A1 BENZONORBORNENYL, BENZOPYRANYL AND BENZOTHIOPYRANYL RETINOIC ACID ANALOGUES SRI INTERNATIONAL (US) 1985-10-02 EP disclosed
WO-1985000806-A1 BENZONORBORNENYL, BENZOPYRANYL AND BENZOTHIOPYRANYL RETINOIC ACID ANALOGUES SRI INTERNATIONAL (US) 1985-02-28 WO disclosed
US-4326055-A ANTITUMOR AGENTS, SKIN DISORDERS, RHEUMATIC DISEASES HOFFMANN-LA ROCHE INC. (US) 1982-04-20 US disclosed
US-4316983-A Neoplasmic compounds: sugar esters and glycosides HOFFMANN-LA ROCHE INC. (US) 1982-02-23 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 (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-10752591-B2 18-20 member bi-polycyclic compounds TNNI3, TNNC1, MYLK2 RARG 4129/4885RARB 3587/4885RARA 4139/4885
US-10377715-B2 18-20 member bi-polycyclic compounds CKMT1A; CKMT1B, MYLK2, CPT1B RARG 845/4885RARB 1026/4885RARA 1809/4885
US-20180362467-A1 18-20 MEMBER BI-POLYCYCLIC COMPOUNDS CKMT1A; CKMT1B, MYLK2, CPT1B RARG 845/4885RARB 1026/4885RARA 1809/4885
US-10954194-B2 18-20 member bi-polycyclic compounds BRCA1, UGT2B17, TP53 RARG 862/4885RARB 1128/4885RARA 1079/4885
US-20170114019-A1 18-20 MEMBER BI-POLYCYCLIC COMPOUNDS CKMT1A; CKMT1B, MYLK2, CPT1B RARG 845/4885RARB 1026/4885RARA 1809/4885

“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.