SCHEMBL8540890

SCHEMBL8540890

CCCCC[SiH]1CCC(c2ccc(-c3ccc(OC(F)(F)F)cc3F)c(F)c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.38
GRM2 Q14416 2/20 0.36
GPR3 P46089 4/20 0.33
KDM1A O60341 1/20 0.33
RCOR1 Q9UKL0 1/20 0.33
PDE2A O00408 2/20 0.32
FFAR1 O14842 3/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
CYP1A2 P05177 1/20 0.30
SCN9A Q15858 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
SCHEMBL8540893 1.00 FFAR4 (0.38) FFAR4GRM2GPR3KDM1ARCOR1
SCHEMBL8538287 0.92 FFAR4 (0.38) FFAR4GRM2GPR3KDM1ARCOR1
SCHEMBL8538286 0.92 FFAR4 (0.38) FFAR4GRM2GPR3KDM1ARCOR1
SCHEMBL7753057 0.92 GRM2 (0.39) FFAR4GRM2KDM1ARCOR1FFAR1
SCHEMBL7753060 0.92 GRM2 (0.39) FFAR4GRM2KDM1ARCOR1FFAR1
SCHEMBL7773875 0.87 GRM2 (0.40) FFAR4GRM2FFAR1SCN9A
SCHEMBL7773877 0.87 GRM2 (0.40) FFAR4GRM2FFAR1SCN9A
SCHEMBL8017659 0.86 GRM2 (0.36) FFAR4GRM2KDM1ARCOR1FFAR1
SCHEMBL8017658 0.86 GRM2 (0.36) FFAR4GRM2KDM1ARCOR1FFAR1
SCHEMBL8393129 0.86 CRBN (0.38) CYP1A2

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-5762826-A Liquid crystal composition and a liquid crystal display element which contains it SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-06-09 US disclosed