SCHEMBL7799798

SCHEMBL7799798

COC(=O)/C=C(\C)c1ccc2c(c1)C(C)(c1ccc3c(c1)C(C)(C)CCC3(C)C)CO2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARG P13631 14/20 0.48
RARB P10826 12/20 0.48
RARA P10276 12/20 0.46
RXRA P19793 14/20 0.43
CYP26A1 O43174 3/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
NFKB1 P19838 1/20 0.43
CYP2C19 P33261 1/20 0.43
THPO P40225 1/20 0.43
MTOR P42345 1/20 0.43

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
SCHEMBL7802962 1.00 RARG (0.48) RARGRARBRARARXRACYP26A1
SCHEMBL7794000 0.89 RXRA (0.52) RARGRARBRARARXRACYP26A1
SCHEMBL7794003 0.89 RXRA (0.52) RARGRARBRARARXRACYP26A1
SCHEMBL7793999 0.89 RXRA (0.52) RARGRARBRARARXRACYP26A1
SCHEMBL6734636 0.85 CYP3A4 (0.51) RARGRARBRARARXRACYP26A1
SCHEMBL7799673 0.84 RXRA (0.50) RARGRARBRARARXRACYP26A1
SCHEMBL6730217 0.82 RXRA (0.57) RARGRARBRARARXRACYP26A1
SCHEMBL7794075 0.81 KDM4E (0.49) RARGRARBRARARXRACYP26A1
SCHEMBL7794083 0.81 KDM4E (0.49) RARGRARBRARARXRACYP26A1
SCHEMBL8328210 0.80 RARG (0.69) RARGRARBRARARXRACYP26A1

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-0882033-B1 BENZOFURAN-ACRYLIC ACID DERIVATIVES AND THEIR USE AS MODULATORS OF RXRS OR RARS RECEPTORS CT INTERNAT DE RECH S (FR) 2001-08-16 EP claimed