SCHEMBL5362057

SCHEMBL5362057

CN1CCc2cc(/C=C/C(=O)O)oc2C1c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.57
RARA P10276 2/20 0.50
CYP26A1 O43174 2/20 0.45
CYP3A4 P08684 1/20 0.44
CYP26B1 Q9NR63 1/20 0.42
RARB P10826 3/20 0.41
RARG P13631 3/20 0.41
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40

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
SCHEMBL5359410 0.73 RXRA (1.00) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL5359405 0.73 RXRA (1.00) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL5356754 0.72 RXRA (1.00) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL14212730 0.72 RXRA (1.00) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL5356750 0.72 RXRA (1.00) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL29503658 0.72 RXRA (1.00) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL5364757 0.69 CYP26A1 (0.74) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL7872156 0.69 CYP26A1 (0.74) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL5359919 0.66 RXRA (1.00) RXRARARACYP26A1CYP3A4CYP26B1
SCHEMBL5359932 0.66 RXRA (1.00) RXRARARACYP26A1CYP3A4CYP26B1

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
US-7173134-B2 Selective RXR ligands SMITHKLINE BEECHAM CORPORATION (US) 2007-02-06 US disclosed