SCHEMBL6569178

SCHEMBL6569178

CC/C=C/CCc1cc(F)c(C(=O)O)c(F)c1-c1cc(F)c(C#N)c(F)c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.33
PTPN1 P18031 1/20 0.33
PTPN11 Q06124 1/20 0.33
FASN P49327 1/20 0.31
GRIA2 P42262 2/20 0.30
GRIA4 P48058 2/20 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
SCHEMBL6569182 1.00 PTPN2 (0.33) PTPN2PTPN1PTPN11FASNGRIA2
SCHEMBL7728379 0.73 PTPN1 (0.42) PTPN2PTPN1PTPN11
SCHEMBL7736470 0.71 CES2 (0.33) PTPN1PTPN11
SCHEMBL6569177 0.69 PTPN1 (0.33) PTPN1PTPN11
SCHEMBL6898541 0.69 PTPN1 (0.33) PTPN1PTPN11
SCHEMBL7736815 0.68 RARB (0.39)
SCHEMBL7738987 0.68 RARB (0.41) PTPN1PTPN11
SCHEMBL7736708 0.66 FFAR4 (0.38)
SCHEMBL7738944 0.66 RARB (0.48)
SCHEMBL8860646 0.66 KDM1A (0.36) FASN

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
EP-0919536-B1 Fluorine-substituted 4-alkenylbenzoic acid and derivatives thereof, and nematic liquid crystal composition containing cyanophenyl benzoate derivatives and liquid crystal display system using the same DAINIPPON INK & CHEMICALS (JP) 2004-04-07 EP disclosed