SCHEMBL8045165

SCHEMBL8045165

COC(CC(=Cc1ccc2c(c1)C(c1ccc(C)cc1)=CCC2(C)C)c1ccc(C(=O)O)cc1)OC

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARB P10826 17/20 0.58
RARG P13631 15/20 0.58
RARA P10276 15/20 0.58
RXRA P19793 1/20 0.58
NR2E1 Q9Y466 1/20 0.58

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
SCHEMBL5327556 0.91 RARB (0.47) RARBRARGRARARXRANR2E1
SCHEMBL8600911 0.88 RARB (0.52) RARBRARGRARARXRANR2E1
SCHEMBL8045346 0.85 RARA (0.54) RARBRARGRARARXRANR2E1
SCHEMBL8045349 0.85 RARA (0.54) RARBRARGRARARXRANR2E1
SCHEMBL8045347 0.85 RARA (0.54) RARBRARGRARARXRANR2E1
SCHEMBL6238257 0.83 RARB (0.83) RARBRARGRARARXRANR2E1
SCHEMBL6238262 0.83 RARB (0.83) RARBRARGRARARXRANR2E1
SCHEMBL6259665 0.81 RARB (0.63) RARBRARGRARARXRANR2E1
SCHEMBL13785038 0.78 RARB (0.77) RARBRARGRARARXRANR2E1
SCHEMBL6238148 0.78 RARB (0.77) RARBRARGRARARXRANR2E1

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-6087505-A Benzo[1,2-G]-chrom-3-ene, and benzo[1,2-G]-thiochrom-3-ene derivatives ALLERGAN SALES, INC. (US) 2000-07-11 US disclosed