SCHEMBL7949397

SCHEMBL7949397

C=CC(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc(P(=O)(OCC)OCC)s1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP26B1 Q9NR63 1/20 0.34
RXRA P19793 4/20 0.34
RXRB P28702 3/20 0.34
RARA P10276 7/20 0.32
RARB P10826 7/20 0.32
RARG P13631 7/20 0.32
RXRG P48443 2/20 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
SCHEMBL7929520 0.84 RXRA (0.42) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7931972 0.76 RXRA (0.38) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7929418 0.74 RARB (0.50) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7931979 0.73 RARB (0.36) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL9484572 0.68 POLB (0.52) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL9483500 0.68 RXRA (0.42) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7929448 0.67 NPC1 (0.43) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7929435 0.67 RXRA (0.32) RXRARXRBRARARARBRARG
SCHEMBL9318355 0.67 RXRA (0.41) CYP26A1CYP3A4CYP26B1RXRARXRB
SCHEMBL7922809 0.67 RXRA (0.43) CYP26A1CYP3A4CYP26B1RXRARXRB

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-6265423-B1 SKIN DISORDERS; ANTICANCER AGENTS CENTRE EUROPEEN DE BIOPROSPECTIVE-CEB (FR) 2001-07-24 US disclosed