SCHEMBL8908240

SCHEMBL8908240

COc1cc2c(cc1C(O)COc1ccc(C(=O)O)c(O)c1)C(C)(C)CCC2(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP26B1 Q9NR63 1/20 0.48
RXRA P19793 11/20 0.45
HNF4A P41235 5/20 0.43
RARG P13631 2/20 0.40
RARB P10826 2/20 0.38
PPARG P37231 1/20 0.38
MAOB P27338 1/20 0.38
RARA P10276 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38

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
SCHEMBL8907733 0.89 CYP26A1 (0.52) CYP26A1CYP3A4CYP26B1RXRAHNF4A
SCHEMBL5084224 0.82 CYP26A1 (0.72) CYP26A1CYP3A4CYP26B1RXRARARG
SCHEMBL9269947 0.81 RXRA (0.49) CYP26A1CYP3A4CYP26B1RXRAHNF4A
SCHEMBL8907763 0.80 RXRA (0.53) CYP26A1CYP3A4CYP26B1RXRAHNF4A
SCHEMBL8907898 0.78 CYP26A1 (0.69) CYP26A1CYP3A4CYP26B1RXRARARG
SCHEMBL7709232 0.77 RXRA (0.45) CYP26A1CYP3A4CYP26B1RXRAHNF4A
SCHEMBL9262524 0.77 RXRA (0.48) CYP26A1CYP3A4CYP26B1RXRAHNF4A
SCHEMBL8907847 0.74 CYP26A1 (0.55) CYP26A1CYP3A4CYP26B1RXRARARG
SCHEMBL8908927 0.74 CYP3A4 (0.55) CYP26A1CYP3A4CYP26B1RXRARARG
SCHEMBL5084222 0.74 CYP3A4 (0.63) CYP26A1CYP3A4CYP26B1RXRARARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0514264-B1 Biaromatic compounds derived from compounds having a salicylic configuration, their preparation process and their use in human and veterinary medicine and in cosmetics CIRD GALDERMA (FR) 1995-11-15 EP claimed
US-5654331-A SKIN AND RESPIRATORY SYSTEM DISORDERS; ANTIINFLAMMATORY AGENTS; ANTIALLERGENS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1997-08-05 US disclosed
US-5476860-A Diaromatic compounds derived from a salicylic unit and their use in human and veterinary medicine and in cosmetics CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (CIRD GALDERMA) (FR) 1995-12-19 US disclosed