SCHEMBL8008409

SCHEMBL8008409

CCOc1cc2c(cc1C1(CC=O)CC1)C(C)(C)CCC2(C)C

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RXRA P19793 17/20 0.46
HNF4A P41235 9/20 0.46
RXRG P48443 6/20 0.46
RARA P10276 4/20 0.46
RARB P10826 4/20 0.46
RARG P13631 4/20 0.46
RXRB P28702 4/20 0.46
LMNA P02545 1/20 0.33

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
SCHEMBL6917452 0.89 RXRA (0.47) RXRAHNF4ARXRGRARARARB
SCHEMBL6917266 0.85 RXRA (0.46) RXRAHNF4ARXRGRARARARB
SCHEMBL8421087 0.85 RXRA (0.41) RXRAHNF4ARXRGRARARARB
SCHEMBL6917354 0.83 CCNB2 (0.38) RXRAHNF4ARXRGRARARARB
SCHEMBL8008143 0.78 RXRA (0.47) RXRAHNF4ARXRGRARARARB
SCHEMBL7723187 0.78 RXRA (0.70) RXRAHNF4ARXRGRARARARB
SCHEMBL7723183 0.78 RXRA (0.70) RXRAHNF4ARXRGRARARARB
SCHEMBL8005836 0.77 RXRA (0.59) RXRARXRGRARARARBRARG
SCHEMBL7156085 0.77 RXRA (0.48) RXRAHNF4ARXRGRARARARB
SCHEMBL8005483 0.70 RXRA (0.50) RXRAHNF4ARXRGRARARARB

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
WO-2000026173-A1 NOVEL RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE LIGAND PHARMACEUTICALS INCORPORATED (DE) 2000-05-11 WO disclosed
US-6005007-A SKIN DISORDERS LIGAND PHARMACEUTICALS INCORPORATED 1999-12-21 US disclosed