SCHEMBL8448008

SCHEMBL8448008

FC/C=C/CC[C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.49
ESR2 Q92731 3/20 0.41
IDO1 P14902 2/20 0.38
DGAT1 O75907 1/20 0.38
SOAT1 P35610 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 2/20 0.36
ESR1 P03372 1/20 0.36
CYP3A4 P08684 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
MAOB P27338 1/20 0.35
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
GRM2 Q14416 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL8448016 1.00 HTR2C (0.49) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8448011 1.00 HTR2C (0.49) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8451505 0.84 HTR2C (0.45) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8835095 0.84 HTR2C (0.45) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8451509 0.84 HTR2C (0.45) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8451507 0.84 HTR2C (0.45) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8451460 0.83 HTR2C (0.44) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8451463 0.83 HTR2C (0.44) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8451464 0.83 HTR2C (0.44) HTR2CESR2IDO1DGAT1SOAT1
SCHEMBL8456906 0.82 HTR2C (0.46) HTR2CESR2IDO1DGAT1SOAT1

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
EP-0679707-B1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 1999-06-16 EP disclosed
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US disclosed
EP-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed