SCHEMBL14767112

SCHEMBL14767112

CCOc1ccc(CCC2CCC(c3ccc(C4CCC(OCC)CC4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.34
HTR2C P28335 5/20 0.34
OPRL1 P41146 4/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
FFAR1 O14842 4/20 0.32
GPR119 Q8TDV5 2/20 0.32
ACACA Q13085 1/20 0.32
HCRTR2 O43614 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NQO2 P16083 1/20 0.31
MTNR1A P48039 1/20 0.31
MTNR1B P49286 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
SCHEMBL14766328 0.95 OPRL1 (0.35) OPRL1CHRNB2CHRNA4FFAR1GPR119
SCHEMBL14766639 0.92 CNR2 (0.34) HTR2AHTR2COPRL1FFAR1GPR119
SCHEMBL12718746 0.91 DAO (0.36) HTR2AHTR2COPRL1FFAR1MEN1
SCHEMBL12739759 0.91 HTR2A (0.35) HTR2AHTR2COPRL1CHRNB2CHRNA4
SCHEMBL12739757 0.91 HTR2A (0.35) HTR2AHTR2COPRL1CHRNB2CHRNA4
SCHEMBL12739768 0.90 HTR2A (0.34) HTR2AHTR2COPRL1CHRNB2CHRNA4
SCHEMBL14766966 0.90 HTR2A (0.33) HTR2AHTR2CMEN1KMT2AMTNR1A
SCHEMBL12739767 0.89 FFAR1 (0.35) HTR2AHTR2CFFAR1ACACAMEN1
SCHEMBL14766754 0.88 CNR2 (0.37) HTR2AHTR2CFFAR1GPR119
SCHEMBL14766448 0.88 FFAR1 (0.31) HTR2AHTR2CFFAR1ACACA

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed