SCHEMBL18007124

SCHEMBL18007124

CCCc1ccc(C)c(CO)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
VDR P11473 1/20 0.48
SHBG P04278 1/20 0.42
ALOX5 P09917 2/20 0.42
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
SKP2 Q13309 1/20 0.40
BACE1 P56817 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
S1PR1 P21453 1/20 0.36
PLK1 P53350 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35

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
SCHEMBL1263571 0.87 CNR1 (0.47) CNR1CNR2VDRALOX5LPL
SCHEMBL10239021 0.86 CNR1 (0.47) CNR1CNR2VDRSHBGALOX5
SCHEMBL13953779 0.85 CNR1 (0.50) CNR1CNR2VDRALOX5LPL
SCHEMBL9656290 0.85 CNR1 (0.45) CNR1CNR2VDRALOX5LPL
SCHEMBL9443611 0.85 PTGS2 (0.52) SHBGLPLLIPGSKP2CYP3A4
SCHEMBL11720734 0.83 CNR1 (0.48) CNR1CNR2VDRALOX5LPL
SCHEMBL8773463 0.83 TRPA1 (0.46) VDRSHBGALOX5LPLLIPG
SCHEMBL148755 0.82 SHBG (0.48) VDRSHBGS1PR1TAAR1
SCHEMBL29741490 0.82 SHBG (0.48) VDRSHBGS1PR1TAAR1
SCHEMBL13966467 0.82 CNR1 (0.62) CNR1CNR2ALOX5BACE1CYP3A4

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-20160231626-A1 A LIQUID CRYSTAL ALIGNMENT FILM AND A LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2016-08-11 US disclosed