SCHEMBL28656339

SCHEMBL28656339

OCC(F)(F)OOCC(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.31

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
SCHEMBL798350 0.69 CA1 (0.38) HTT
SCHEMBL4298770 0.65 HTT (0.32) HTT
SCHEMBL6233581 0.64
SCHEMBL798352 0.64 CA1 (0.35) HTT
SCHEMBL4298768 0.63 CA1 (0.31)
SCHEMBL21735552 0.63
SCHEMBL14689042 0.62 HTT (0.39) HTT
SCHEMBL9968801 0.61
Trifluoroethanol SCHEMBL8952016 0.61
Trifluoroethanol SCHEMBL4869 0.61

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
CN-110114358-B Novel compound and pharmacologically acceptable salt thereof 明治制果药业株式会社 2021-12-03 CN disclosed