SCHEMBL8028151

SCHEMBL8028151

COC(=O)c1ccc(C(=O)c2ccc3c(c2)C(c2ccccc2)=CCC3(C)C)cc1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARB P10826 19/20 0.62
RARA P10276 19/20 0.62
RARG P13631 18/20 0.62
RXRA P19793 1/20 0.59
NR2E1 Q9Y466 1/20 0.59

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
SCHEMBL12365355 0.93 RARB (0.67) RARBRARARARGRXRANR2E1
SCHEMBL8026107 0.89 RARB (0.60) RARBRARARARGRXRANR2E1
SCHEMBL7800412 0.87 RARA (0.58) RARBRARARARGRXRANR2E1
SCHEMBL8026108 0.87 RARA (0.80) RARBRARARARGRXRANR2E1
SCHEMBL27462421 0.85 RARA (0.72) RARBRARARARGRXRANR2E1
SCHEMBL7809402 0.83 RARB (0.53) RARBRARARARGRXRANR2E1
SCHEMBL8771650 0.83 RARB (0.77) RARBRARARARGRXRANR2E1
SCHEMBL8026706 0.82 CYP3A4 (0.42) RARBRARARARGRXRANR2E1
SCHEMBL8771964 0.82 RARB (0.68) RARBRARARARGRXRANR2E1
SCHEMBL8842937 0.81 RARA (0.64) 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
WO-2000059861-A1 SELECTIVE RETINOIC ACID ANALOGS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-10-12 WO disclosed