SCHEMBL14960958

SCHEMBL14960958

C=CCCC1CCC(CC(F)COc2ccc(-c3ccc(OCCCCCCC)c(F)c3)c(F)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.35
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
FFAR4 Q5NUL3 5/20 0.34
PPARD Q03181 3/20 0.33
CNR1 P21554 3/20 0.33
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
S1PR1 P21453 3/20 0.32
S1PR3 Q99500 3/20 0.32
S1PR4 O95977 1/20 0.32
S1PR5 Q9H228 1/20 0.32
FFAR1 O14842 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 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
SCHEMBL10021304 0.83 KDM1A (0.38) PPARDFFAR1
SCHEMBL8933840 0.77 GABRA1 (0.34) CNR2GABRA1GABRB2PPARDCNR1
SCHEMBL8933738 0.77 GABRA1 (0.34) CNR2GABRA1GABRB2PPARDCNR1
SCHEMBL8933846 0.77 GABRA1 (0.34) CNR2GABRA1GABRB2PPARDCNR1
SCHEMBL8933755 0.77 GABRA1 (0.34) CNR2GABRA1GABRB2PPARDCNR1
SCHEMBL8933657 0.76 GABRA1 (0.35) CNR2GABRA1GABRB2PPARDCNR1
SCHEMBL8959598 0.75 GABRA1 (0.33) CNR2GABRA1GABRB2PPARDCNR1
SCHEMBL8959829 0.75 GABRA1 (0.33) CNR2GABRA1GABRB2PPARDCNR1
SCHEMBL8959725 0.75 GABRA1 (0.33) CNR2GABRA1GABRB2PPARDCNR1
SCHEMBL8959635 0.75 GABRA1 (0.33) CNR2GABRA1GABRB2PPARDCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846164-B2 Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof JNC CORPORATION (JP) 2014-09-30 US disclosed
US-8846164-B2 Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof JNC CORPORATION (JP) 2014-09-30 US disclosed
US-20130126783-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JNC PETROCHEMICAL CORPORATION (JP) 2013-05-23 US disclosed
US-20130126783-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JNC PETROCHEMICAL CORPORATION (JP) 2013-05-23 US disclosed