SCHEMBL14286010

SCHEMBL14286010

BCc1ccc2c(c1)C(CC)(CC)CCC2(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.42
RXRB P28702 4/20 0.42
RXRG P48443 4/20 0.42
CYP26B1 Q9NR63 8/20 0.40
CYP26A1 O43174 7/20 0.40
RARA P10276 2/20 0.36
RARB P10826 2/20 0.36
RARG P13631 2/20 0.36
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
PPARG P37231 2/20 0.35
CYP3A4 P08684 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL14286073 0.86 RXRA (0.53) RXRARXRBRXRGCYP26B1CYP26A1
SCHEMBL2238564 0.84 RXRA (0.42) RXRARXRBRXRGCYP26B1CYP26A1
SCHEMBL13318274 0.77 RXRA (0.42) RXRARXRBRXRGCYP26B1CYP26A1
SCHEMBL14286050 0.75 RXRA (0.41) RXRARXRBRXRGCYP26B1CYP26A1
SCHEMBL3176733 0.73 RXRA (0.54) RXRARXRBRXRGCYP26B1CYP26A1
SCHEMBL2090508 0.73 ESR2 (0.42) RXRARXRBRXRGCYP26B1CYP26A1
SCHEMBL2897524 0.70 CYP26B1 (0.53) RXRARXRBRXRGCYP26B1CYP26A1
SCHEMBL2090382 0.70 ESR2 (0.40) ESR1ESR2TP53
SCHEMBL694638 0.68 RXRA (0.53) RXRARXRBRXRGCYP26B1CYP26A1
SCHEMBL1616186 0.68 RXRA (0.53) RXRARXRBRXRGCYP26B1CYP26A1

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
WO-2008030618-A1 BENZO-FUSED COMPOUNDS FOR USE IN TREATING METABOLIC DISORDERS AMGEN INC. (US) 2008-03-13 WO disclosed