SCHEMBL8600911

SCHEMBL8600911

COC(CC(=Cc1ccc2c(c1)C(c1ccc(C)cc1)=CCC2(C)C)c1ccccc1C(=O)O)OC

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARB P10826 17/20 0.52
RARA P10276 15/20 0.52
RARG P13631 15/20 0.52
RXRA P19793 1/20 0.52
NR2E1 Q9Y466 1/20 0.52

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
SCHEMBL8045165 0.88 RARB (0.58) RARBRARARARGRXRANR2E1
SCHEMBL8603302 0.86 RARB (0.44) RARBRARARARGRXRANR2E1
SCHEMBL8603304 0.86 RARB (0.44) RARBRARARARGRXRANR2E1
SCHEMBL5327556 0.82 RARB (0.47) RARBRARARARGRXRANR2E1
SCHEMBL8332863 0.79 RARB (0.66) RARBRARARARGRXRANR2E1
SCHEMBL8331621 0.79 RARB (0.66) RARBRARARARGRXRANR2E1
SCHEMBL6398394 0.75 RARB (0.60) RARBRARARARGRXRANR2E1
SCHEMBL8045349 0.73 RARA (0.54) RARBRARARARGRXRANR2E1
SCHEMBL8045347 0.73 RARA (0.54) RARBRARARARGRXRANR2E1
SCHEMBL8045346 0.73 RARA (0.54) RARBRARARARGRXRANR2E1

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-5728846-A RETENOIDS, RETINOID ACTIVITY; AGONISTS, ANTAGONISTS ALLERGAN (US) 1998-03-17 US disclosed