SCHEMBL8767577

SCHEMBL8767577

Fc1ccc(-c2ncc(CCCCC3CCCC3)cn2)cc1F

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.37
RARB P10826 1/20 0.35
PDGFRB P09619 1/20 0.35
PDGFRA P16234 1/20 0.35
SPHK1 Q9NYA1 2/20 0.34
BRS3 P32247 1/20 0.34
GRIN2B Q13224 2/20 0.33
XDH P47989 1/20 0.33
GRM2 Q14416 1/20 0.33
CEL P19835 1/20 0.33
MOGAT2 Q3SYC2 1/20 0.33

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
SCHEMBL8767859 0.99 RARB (0.37) TDP1RARBPDGFRBPDGFRASPHK1
SCHEMBL8767155 0.99 RARB (0.37) TDP1RARBPDGFRBPDGFRASPHK1
SCHEMBL8768327 0.99 RARB (0.37) TDP1RARBPDGFRBPDGFRASPHK1
SCHEMBL8768454 0.86 XDH (0.45) XDH
SCHEMBL8767203 0.85 RAB9A (0.46) TDP1GRM2
SCHEMBL8768280 0.85 XDH (0.44) XDH
SCHEMBL8768299 0.85 XDH (0.44) XDH
SCHEMBL9649673 0.84 RARB (0.41) RARBPDGFRBPDGFRAGRIN2BGRM2
SCHEMBL9649663 0.84 RARB (0.41) RARBPDGFRBPDGFRAGRIN2BGRM2
SCHEMBL9648727 0.83 RARB (0.43) RARBPDGFRBPDGFRAGRIN2BGRM2

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-0789067-A1 Cyclopentyl derivatives useful as liquid crystals Rolic AG (CH) 1997-08-13 EP disclosed