SCHEMBL22683283

SCHEMBL22683283

CC(=O)Nc1ncc(CN2CCC(c3ccc(OC(F)(F)F)cc3)CC2)s1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 19/20 0.70
▸ HTT P42858 1/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61

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
SCHEMBL16112716 0.88 OGA (0.68) OGAHTTSMN1; SMN2
SCHEMBL16113250 0.86 OGA (0.73) OGAHTTSMN1; SMN2
SCHEMBL16113629 0.85 OGA (0.66) OGAHTTSMN1; SMN2
SCHEMBL16112772 0.85 OGA (0.73) OGAHTTSMN1; SMN2
SCHEMBL16113559 0.84 OGA (0.80) OGAHTTSMN1; SMN2
SCHEMBL16113405 0.83 OGA (0.67) OGAHTTSMN1; SMN2
SCHEMBL16112443 0.83 OGA (0.61) OGAHTTSMN1; SMN2
SCHEMBL20586821 0.82 OGA (1.00) OGA
SCHEMBL16113037 0.82 OGA (0.62) OGAHTTSMN1; SMN2
SCHEMBL20281543 0.81 OGA (0.59) OGA

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-3389658-B1 GLYCOSIDASE INHIBITORS AND USES THEREOF MERCK SHARP & DOHME (US) 2020-11-25 — — EP disclosed
Send feedback