SCHEMBL11218909

SCHEMBL11218909

[CH2]c1ccc2c(c1)C(C)(C)CC2(C)C

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 14/20 0.35
RXRB P28702 11/20 0.35
RARB P10826 9/20 0.35
RARG P13631 8/20 0.35
RXRG P48443 7/20 0.35
RARA P10276 6/20 0.35
CYP26A1 O43174 2/20 0.31
CYP3A4 P08684 1/20 0.31
CRABP2 P29373 1/20 0.31
CYP26B1 Q9NR63 1/20 0.31

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
SCHEMBL4047286 0.86 RXRA (0.46) RXRARXRBRARBRARGRXRG
SCHEMBL3179509 0.74 CYP3A4 (0.37) RXRARXRBRARBRARGRXRG
SCHEMBL24618514 0.73 AKR1B1 (0.36) RXRARXRBRARBRARGRXRG
SCHEMBL2224319 0.73 KDM1A (0.35) RXRARXRBRARBRARGRXRG
SCHEMBL9446453 0.73 KDM4E (0.38) RXRARXRBRARBRARGRXRG
SCHEMBL9721391 0.73 OPRM1 (0.41) RXRARXRBRARBRARGRXRG
SCHEMBL10533866 0.71 CA1 (0.42) RXRARXRBRXRGCYP3A4
SCHEMBL22180771 0.71 RARB (0.41) RXRARXRBRARBRARGRXRG
SCHEMBL2353102 0.69 HTR2A (0.39)
SCHEMBL3552820 0.68 RXRA (0.41) RXRARXRBRARBRARGRXRG

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-0002742-B1 STILBENE DERIVATIVES, THEIR PREPARATION AND MEDICINES CONTAINING THESE STILBENE DERIVATIVES F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1982-04-14 EP disclosed