SCHEMBL14766966

SCHEMBL14766966

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

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.33
MTNR1A P48039 2/20 0.32
HTR2C P28335 2/20 0.31
GAA P10253 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30

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
SCHEMBL14765774 0.95 OPRL1 (0.32) MTNR1A
SCHEMBL14766448 0.90 FFAR1 (0.31) HTR2AHTR2C
SCHEMBL14767112 0.90 HTR2A (0.34) HTR2AMTNR1AHTR2CMEN1KMT2A
SCHEMBL14767034 0.89 HTR2A (0.35) HTR2AMTNR1AHTR2CMEN1LMNA
SCHEMBL12739778 0.89 HTR2A (0.34) HTR2AMTNR1AHTR2CGAAMEN1
SCHEMBL14765894 0.86 OPRL1 (0.31)
SCHEMBL14766813 0.86 FFAR4 (0.33) HTR2AMTNR1AGAAMEN1LMNA
SCHEMBL14766805 0.86 HTR2C (0.35) HTR2AHTR2CMEN1KMT2A
SCHEMBL14765760 0.86 HTR2C (0.35) HTR2AHTR2CMEN1KMT2A
SCHEMBL14766085 0.85 HTR2A (0.33) HTR2AMTNR1AMEN1LMNAMAPT

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