SCHEMBL4882500

SCHEMBL4882500

CC(/C=C/c1ccccc1-c1ccc2c(c1)C(C)(C)CCC2(C)C)=C\C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 19/20 0.62
RARB P10826 8/20 0.62
RARG P13631 8/20 0.62
RXRG P48443 11/20 0.54
RXRB P28702 9/20 0.54
RARA P10276 4/20 0.51
PPARG P37231 1/20 0.50

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
SCHEMBL4882513 1.00 RXRA (0.62) RXRARARBRARGRXRGRXRB
SCHEMBL7565108 0.85 KDM4E (0.47) RXRARARBRARGRXRGRXRB
SCHEMBL7567586 0.85 KDM4E (0.47) RXRARARBRARGRXRGRXRB
SCHEMBL8362236 0.84 RXRA (0.60) RXRARARBRARGRXRGRXRB
SCHEMBL8362245 0.84 RXRA (0.60) RXRARARBRARGRXRGRXRB
SCHEMBL8189844 0.84 RXRA (0.62) RXRARARBRARGRXRGRXRB
SCHEMBL8189841 0.84 RXRA (0.62) RXRARARBRARGRXRGRXRB
SCHEMBL9049113 0.83 RARB (0.50) RXRARARBRARGRXRGRXRB
SCHEMBL8487114 0.83 RARB (0.50) RXRARARBRARGRXRGRXRB
SCHEMBL9049102 0.83 RARB (0.50) RXRARARBRARGRXRGRXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255206-A1 Rxr Agonists and Antagonists, Alone or in Combination with Ppar Ligands, in the Treatment of Metabolic and Cardiovascular Diseases BOLLAG WERNER 2008-10-16 US claimed
EP-0997455-A1 Restricted 9-cis retenoids American Cyanamid Company (US) 2000-05-03 EP claimed
EP-0775103-B1 RETINOIC ACID X-RECEPTOR LIGANDS HOFFMANN LA ROCHE (CH) 1999-06-09 EP claimed
US-5801253-A Retinoic acid X-receptor ligands HOFFMANN-LA ROCHE INC. (US) 1998-09-01 US claimed
EP-0775103-A1 RETINOIC ACID X-RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 1997-05-28 EP claimed
EP-0718285-A2 Restricted 9-cis-retinoids American Cyanamid Company (US) 1996-06-26 EP claimed
WO-1996005165-A1 RETINOIC ACID X-RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 1996-02-22 WO claimed
US-20080255206-A1 Rxr Agonists and Antagonists, Alone or in Combination with Ppar Ligands, in the Treatment of Metabolic and Cardiovascular Diseases BOLLAG WERNER 2008-10-16 US disclosed
US-20080255206-A1 Rxr Agonists and Antagonists, Alone or in Combination with Ppar Ligands, in the Treatment of Metabolic and Cardiovascular Diseases BOLLAG WERNER 2008-10-16 US disclosed
US-20080255206-A1 Rxr Agonists and Antagonists, Alone or in Combination with Ppar Ligands, in the Treatment of Metabolic and Cardiovascular Diseases BOLLAG WERNER 2008-10-16 US disclosed
EP-0848696-B1 2,4-PENTADIENOIC ACID DERIVATIVES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY ALLERGAN SALES INC (US) 2002-08-28 EP disclosed
US-20020082419-A1 2,4-pentadienoic acid derivatives having retinoid-like biological activity ALLERGAN SALES, INC. 2002-06-27 US disclosed
US-6313163-B1 ADMINISTERING 2,4-PENTADIENOIC ACID DERIVATIVE FOR THERAPY OF DISEASE OR CONDITION RESPONSIVE TO THERAPY BY RETINOIDS ALLERGEN SALES, INC. 2001-11-06 US disclosed
US-5801253-A Retinoic acid X-receptor ligands HOFFMANN-LA ROCHE INC. (US) 1998-09-01 US disclosed
US-5780647-A 2,4-Pentadienoic acid derivatives having retinoid-like biological activity ALLERGAN (US) 1998-07-14 US disclosed
US-5675033-A FOR TREATMENT OF SKIN DISORDERS ALLERGAN (US) 1997-10-07 US disclosed
US-5663367-A REGULATOR OF CELL PROLIFERATION AND DIFFERENTIATION; TREATMENT OF SKIN DISORDERS, ANTIINFLAMMATORY AGENTS, ANTICARCINOGENIC AGENTS ALLERGAN (US) 1997-09-02 US disclosed
EP-0775103-A1 RETINOIC ACID X-RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 1997-05-28 EP disclosed
EP-0718285-A2 Restricted 9-cis-retinoids American Cyanamid Company (US) 1996-06-26 EP disclosed
WO-1996005165-A1 RETINOIC ACID X-RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 1996-02-22 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 (2 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-20020082419-A1 2,4-pentadienoic acid derivatives having retinoid-like biological activity RXRA, RXRB, CBR1 RXRA 1/4885RARB 13/4885RARG 30/4885
US-20080255206-A1 Rxr Agonists and Antagonists, Alone or in Combination with Ppar Ligands, in the Treatment of Metabolic and Cardiovascular Diseases RXRA, RXRG, RXRB RXRA 1/4885RARB 10/4885RARG 8/4885

“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.