SCHEMBL7899482

SCHEMBL7899482

COC(=O)c1cccc(C(=O)c2ccc3c(c2)C(C)(C)CCC3(C)C)c1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXRA P19793 9/20 0.61
RARB P10826 8/20 0.61
RXRB P28702 7/20 0.61
RARG P13631 6/20 0.61
RXRG P48443 5/20 0.61
CYP3A4 P08684 5/20 0.60
CYP26A1 O43174 6/20 0.57
RARA P10276 5/20 0.57
CYP26B1 Q9NR63 2/20 0.57
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48
LOXL2 Q9Y4K0 1/20 0.46
HNF4A P41235 1/20 0.45

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
SCHEMBL7422927 0.90 RXRA (0.70) RXRARARBRXRBRARGRXRG
SCHEMBL2788640 0.90 CYP3A4 (0.70) RXRARARBRXRBRARGRXRG
SCHEMBL7896511 0.89 RXRA (0.63) RXRARARBRXRBRARGRXRG
SCHEMBL6901737 0.85 RXRA (0.61) RXRARARBRXRBRARGRXRG
SCHEMBL7761329 0.84 RARB (0.80) RXRARARBRXRBRARGRXRG
SCHEMBL8733241 0.83 RARB (0.83) RXRARARBRXRBRARGRXRG
SCHEMBL9047780 0.83 RARB (0.51) RXRARARBRXRBRARGRXRG
SCHEMBL10459708 0.82 RXRA (0.56) RXRARARBRXRBRARGRXRG
SCHEMBL2194599 0.82 RARB (0.82) RXRARARBRXRBRARGRXRG
SCHEMBL9319204 0.81 CYP3A4 (0.67) RXRARARBRXRBRARGRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6258775-B1 3-(3-(5,5,8,8-TETRAMATHYL-5,6,7,8-TETRAHYDRO-2-NAPHTYLCARBONYL )PHENYL)ACRYLIC ACID FOR TREATING DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2001-07-10 US disclosed
EP-1048659-A1 RETINOID RECEPTOR AGONISTS Institute of Medicinal Molecular Design, Inc. (JP) 2000-11-02 EP disclosed