SCHEMBL6239276

SCHEMBL6239276

CCOc1cc2c(cc1-c1ccccc1C(=O)c1ccc(C(=O)O)cc1Cl)C(C)(C)CCC2(C)C

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 17/20 0.58
HNF4A P41235 9/20 0.58
RARG P13631 4/20 0.44
RARB P10826 3/20 0.44
RXRG P48443 2/20 0.42
RXRB P28702 1/20 0.42

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
SCHEMBL6242408 0.83 RXRA (0.59) RXRAHNF4ARARG
SCHEMBL6269934 0.80 RXRA (0.59) RXRAHNF4ARARGRARBRXRG
SCHEMBL6242411 0.77 RXRA (0.50) RXRAHNF4ARARGRARBRXRG
SCHEMBL6239279 0.77 RXRA (0.58) RXRAHNF4ARARGRARB
SCHEMBL6239175 0.77 RXRA (0.67) RXRAHNF4ARARGRARBRXRG
SCHEMBL6914152 0.74 RXRA (1.00) RXRAHNF4ARARGRARBRXRG
SCHEMBL6240335 0.72 RXRA (0.56) RXRAHNF4ARARGRARBRXRG
SCHEMBL6240826 0.71 RXRA (0.58) RXRAHNF4ARARGRARBRXRG
SCHEMBL6239181 0.71 RXRA (0.55) RXRAHNF4ARARGRARBRXRG
SCHEMBL22394641 0.71 LMNA (0.43) RXRARXRB

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-2005017185-A2 HEPATOCYTE NUCLEAR FACTOR 4α MODULATOR COMPOUNDS LIGAND PHARMCEUTICALS INCORPORATED (US) 2005-02-24 WO claimed
WO-2005017185-A2 HEPATOCYTE NUCLEAR FACTOR 4α MODULATOR COMPOUNDS LIGAND PHARMCEUTICALS INCORPORATED (US) 2005-02-24 WO disclosed