SCHEMBL14765699

SCHEMBL14765699

C=CCOc1ccc(C2CCC(/C=C/c3ccc(-c4ccc(OCC)cc4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GYS1 P13807 1/20 0.31
HTR2C P28335 3/20 0.31
HTR2B P41595 2/20 0.31
HTR2A P28223 1/20 0.30
LMNA P02545 1/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL14766316 1.00 GYS1 (0.31) GYS1HTR2CHTR2BHTR2ALMNA
SCHEMBL14766686 0.93 FPR2 (0.31)
SCHEMBL14765692 0.93 FPR2 (0.31)
SCHEMBL14765919 0.92
SCHEMBL14766260 0.92
SCHEMBL12734250 0.91 HTR2C (0.32) HTR2CHTR2BHTR2A
SCHEMBL12739188 0.91 HTR2C (0.32) HTR2CHTR2BHTR2A
SCHEMBL14765807 0.91 HTR2C (0.36) GYS1HTR2CHTR2BHTR2ALMNA
SCHEMBL14766706 0.89 FFAR4 (0.33) GYS1LMNANPC1POLBMAPT
SCHEMBL14765904 0.88 FFAR4 (0.34) GYS1LMNANPC1POLBMAPT

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