SCHEMBL8456906

SCHEMBL8456906

FC/C=C/CC1CCC(c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.46
DGAT1 O75907 3/20 0.41
SOAT1 P35610 1/20 0.41
IDO1 P14902 1/20 0.37
P2RY14 Q15391 6/20 0.36
KIF11 P52732 4/20 0.36
ESR2 Q92731 1/20 0.36
DRD5 P21918 4/20 0.35
DRD1 P21728 3/20 0.35
ADRA1B P35368 3/20 0.35
SIGMAR1 Q99720 3/20 0.35
TMEM97 Q5BJF2 3/20 0.35
ADRA2A P08913 2/20 0.35
HTR1A P08908 2/20 0.35
ADRB3 P13945 2/20 0.35
ADRA2B P18089 2/20 0.35
SLC6A2 P23975 2/20 0.35
AGTR1 P30556 2/20 0.35
DRD3 P35462 2/20 0.35
SLC6A3 Q01959 2/20 0.35

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
SCHEMBL8447722 0.85 DGAT1 (0.34) HTR2CDGAT1SOAT1P2RY14ESR2
SCHEMBL8447729 0.85 ESR2 (0.36) DGAT1ESR2SLC6A2SLC6A3SLC6A4
SCHEMBL8835533 0.85 HTR2C (0.43) HTR2CDGAT1SOAT1IDO1P2RY14
SCHEMBL8453687 0.84 DRD2 (0.38) DGAT1SOAT1IDO1ESR2DRD5
SCHEMBL8452629 0.84 ESR2 (0.35) DGAT1ESR2SLC6A2SLC6A3SLC6A4
SCHEMBL8448011 0.82 HTR2C (0.49) HTR2CDGAT1SOAT1IDO1ESR2
SCHEMBL8448008 0.82 HTR2C (0.49) HTR2CDGAT1SOAT1IDO1ESR2
SCHEMBL8448016 0.82 HTR2C (0.49) HTR2CDGAT1SOAT1IDO1ESR2
SCHEMBL8447881 0.82 CYP2C9 (0.40) DGAT1SOAT1ESR2
SCHEMBL8451655 0.82 SPHK1 (0.34) DGAT1ESR2

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