SCHEMBL7143189

SCHEMBL7143189

CC1(C)CCC(C)(C)c2cc(CCCCCC=O)ccc21

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP26B1 Q9NR63 7/20 0.47
CYP26A1 O43174 7/20 0.47
RXRA P19793 6/20 0.46
RXRB P28702 4/20 0.46
RXRG P48443 2/20 0.46
RARA P10276 3/20 0.42
RARB P10826 2/20 0.42
RARG P13631 2/20 0.42
CYP3A4 P08684 1/20 0.39
PPARG P37231 1/20 0.38
CDK1 P06493 1/20 0.36

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
SCHEMBL8795908 0.88 CYP26B1 (0.51) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL7143302 0.81 CYP26A1 (0.48) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL7142134 0.80 CYP26B1 (0.49) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL4440994 0.79 RARA (0.56) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL6909472 0.78 CYP26B1 (0.50) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL8811030 0.77 CYP26B1 (0.68) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL4668411 0.76 CYP26B1 (0.52) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL9586582 0.75 CYP26B1 (0.70) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL7144931 0.75 CYP26B1 (0.58) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL2897524 0.74 CYP26B1 (0.53) CYP26B1CYP26A1RXRARXRBRXRG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1301505-A2 THIOPHENE RETINOIDS F. HOFFMANN-LA ROCHE AG (CH) 2003-04-16 EP disclosed
WO-2002004439-A2 THIOPHENE RETINOIDS F. HOFFMANN-LA ROCHE AG (CH) 2002-01-17 WO disclosed