SCHEMBL7769613

SCHEMBL7769613

COC(=O)Oc1ccc2c(c1)OCC2(C)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 9/20 0.40
CYP26A1 O43174 7/20 0.40
CYP26B1 Q9NR63 5/20 0.40
RXRB P28702 4/20 0.40
PPARG P37231 4/20 0.39
CYP3A4 P08684 3/20 0.38
RXRG P48443 3/20 0.38
RARB P10826 3/20 0.37
RARG P13631 3/20 0.37
RARA P10276 2/20 0.37

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
SCHEMBL7769521 0.92 PPARG (0.40) RXRACYP26A1CYP26B1RXRBPPARG
SCHEMBL7771786 0.88 RXRA (0.44) RXRACYP26A1CYP26B1RXRBCYP3A4
SCHEMBL7771646 0.85 RXRA (0.41) RXRARXRBPPARGCYP3A4RXRG
SCHEMBL7773833 0.84 RXRA (0.39) RXRACYP26A1CYP26B1RXRBPPARG
SCHEMBL7770182 0.83 PPARG (0.37) RXRACYP26A1CYP26B1RXRBPPARG
SCHEMBL6729936 0.83 CYP3A4 (0.49) RXRACYP26A1CYP26B1RXRBCYP3A4
SCHEMBL7769865 0.81 RXRA (0.36) RXRACYP26A1CYP26B1RXRBPPARG
SCHEMBL7771769 0.81 RXRA (0.44) RXRACYP26A1CYP26B1RXRBPPARG
SCHEMBL7771740 0.80 RARA (0.44) PPARGRARBRARGRARA
SCHEMBL7769610 0.79 RXRA (0.40) RXRACYP26A1CYP26B1RXRBPPARG

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
EP-0823903-B1 HETEROCYCLIC DIARYL COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME, AND USES THEREOF CT INTERNAT DE RECH S (FR) 2001-07-18 EP claimed