SCHEMBL7769610

SCHEMBL7769610

C=C(C)C1(c2ccc3c(c2)C(C)(C)CCC3(C)C)COc2ccc(OC(=O)OC)cc21

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.40
RXRB P28702 5/20 0.40
CYP26A1 O43174 5/20 0.40
CYP26B1 Q9NR63 4/20 0.40
RXRG P48443 3/20 0.39
PPARG P37231 4/20 0.37
RARB P10826 3/20 0.37
RARG P13631 3/20 0.37
RARA P10276 2/20 0.37
CYP3A4 P08684 2/20 0.35
ACACB O00763 1/20 0.35

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
SCHEMBL7773833 0.93 RXRA (0.39) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL7769492 0.90 RXRA (0.44) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL6733036 0.85 RARB (0.48) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL7769521 0.84 PPARG (0.40) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL7771635 0.82 RXRA (0.42) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL6737755 0.81 RXRA (0.57) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL6733888 0.80 CYP3A4 (0.45) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL7769613 0.79 RXRA (0.40) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL6737119 0.76 RXRA (0.55) RXRARXRBCYP26A1CYP26B1RXRG
SCHEMBL7769865 0.74 RXRA (0.36) RXRARXRBCYP26A1CYP26B1RXRG

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