SCHEMBL8934276

SCHEMBL8934276

CCCOc1ccc(-c2ccc(-c3ccc(C4CCC(CCC)CC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 9/20 0.35
FFAR4 Q5NUL3 4/20 0.35
FPR2 P25090 2/20 0.35
DGAT1 O75907 1/20 0.34
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 2/20 0.32
HTR2A P28223 1/20 0.32

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
SCHEMBL8960531 0.97 OPRL1 (0.33) OPRL1FFAR4FPR2DGAT1GRIN1
SCHEMBL8934233 0.95 S1PR1 (0.36) OPRL1FFAR4DGAT1GRIN1GRIN2B
SCHEMBL8934081 0.94 OPRL1 (0.34) OPRL1FFAR4FPR2DGAT1GRIN1
SCHEMBL8932615 0.94 OPRL1 (0.36) OPRL1FFAR4FPR2DGAT1GRIN1
SCHEMBL8934323 0.93 OPRL1 (0.33) OPRL1FFAR4FPR2DGAT1GRIN1
SCHEMBL8933952 0.93 PTPN11 (0.35) OPRL1FFAR4FPR2DGAT1
SCHEMBL8934318 0.93 PTPN11 (0.35) OPRL1FFAR4FPR2DGAT1
SCHEMBL8934090 0.93 PTPN11 (0.35) OPRL1FFAR4FPR2DGAT1
SCHEMBL8934269 0.93 PTPN11 (0.35) OPRL1FFAR4FPR2DGAT1
SCHEMBL8934150 0.92 OPRL1 (0.33) OPRL1FFAR4FPR2DGAT1

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-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed