SCHEMBL9576264

SCHEMBL9576264

O=C(O)C=CC(=O)OC(F)(F)C(F)(F)C(F)(CC(F)(F)F)C1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL9576255 0.75 HTT (0.33) HTTNPC1GAASMN1; SMN2
SCHEMBL9719170 0.73 HCAR2 (0.38)
SCHEMBL10457568 0.73 HTT (0.38) HTTNPC1GAASMN1; SMN2
SCHEMBL9576324 0.73 HTT (0.38) HTTNPC1GAASMN1; SMN2
SCHEMBL9576361 0.71 HCAR2 (0.40)
SCHEMBL9576336 0.71 HTT (0.36) HTTNPC1GAASMN1; SMN2
SCHEMBL9576304 0.71 HCAR2 (0.40)
SCHEMBL9576164 0.71 HCAR2 (0.36)
SCHEMBL31190307 0.69 HTT (0.40) HTTNPC1GAASMN1; SMN2
SCHEMBL8152677 0.68 HCAR2 (0.40) HTTNPC1GAASMN1; SMN2

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-0219884-B1 HARD CONTACT LENS MATERIAL Tomei Sangyo Kabushiki Kaisha (JP) 1993-09-29 EP disclosed
US-5142009-A Crosslinked blend of fumaric acid diesters TOMEI SANGYO KABUSHIKI KAISHA (JP) 1992-08-25 US disclosed
US-4868260-A OXYGEN PERMEABILITY TOMEI SANGYO KABUSHIKI KAISHA (JP) 1989-09-19 US disclosed
EP-0219884-A2 Hard contact lens material Tomei Sangyo Kabushiki Kaisha (JP) 1987-04-29 EP disclosed