SCHEMBL7158145

SCHEMBL7158145

CCCc1cc2c(cc1CCc1ccc(C(=O)O)cc1)C(C)(C)CCC2(C)C

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 18/20 0.70
RXRB P28702 10/20 0.59
RXRG P48443 9/20 0.59
RARB P10826 6/20 0.53
RARG P13631 6/20 0.53
RARA P10276 5/20 0.53
HNF4A P41235 1/20 0.50
CYP26A1 O43174 1/20 0.49
CYP3A4 P08684 1/20 0.49
CRABP2 P29373 1/20 0.49

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
SCHEMBL9208986 0.83 RXRA (0.78) RXRARXRBRXRGRARBRARG
SCHEMBL1269026 0.83 RXRA (1.00) RXRARXRBRXRGRARBRARG
SCHEMBL22163720 0.81 RXRA (0.50) RXRARXRBRXRGRARBRARG
SCHEMBL6916396 0.81 RXRA (1.00) RXRARXRBRXRGRARBRARG
SCHEMBL6915230 0.81 RXRA (0.67) RXRARXRBRXRGRARBRARG
SCHEMBL7716684 0.80 RXRA (0.67) RXRARXRBRXRGRARBRARG
SCHEMBL6916398 0.79 RARB (0.68) RXRARXRBRXRGRARBRARG
SCHEMBL14017859 0.79 RARB (0.68) RXRARXRBRXRGRARBRARG
SCHEMBL6913706 0.79 RXRA (0.74) RXRARXRBRXRGRARBRARG
SCHEMBL7158137 0.79 RXRA (0.68) RXRARXRBRXRGRARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6545049-B1 E.g., (2E, 4E, 6E)-7-(3,5-diisopropyl-2-n-heptyloxyphenyl)-3-methylocta-2,4,6-trienoic acid, esters or amides thereof LIGAND PHARMACEUTICALS INCORPORATED 2003-04-08 US disclosed