SCHEMBL22928384

SCHEMBL22928384

CC(=O)NC1COC(CN=[N+]=[N-])CC1O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.33
NEU4 Q8WWR8 1/20 0.32
NEU3 Q9UQ49 1/20 0.32
NEU2 Q9Y3R4 1/20 0.32
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 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
SCHEMBL24943576 0.81 OGA (0.41) OGACYP2C9CYP2C19
SCHEMBL12902089 0.81 OGA (0.41) OGACYP2C9CYP2C19
SCHEMBL10017980 0.81 OGA (0.41) OGACYP2C9CYP2C19
SCHEMBL10023957 0.81 OGA (0.41) OGACYP2C9CYP2C19
SCHEMBL24454424 0.78 HPSE (0.31) OGANEU4NEU3NEU2
SCHEMBL16693125 0.77 NEU4 (0.34) NEU4NEU3NEU2
SCHEMBL22111629 0.77 OGA (0.36) OGANEU4NEU3NEU2
SCHEMBL18880353 0.76 OGA (0.35) OGANEU4NEU3NEU2
SCHEMBL21966219 0.73 OGA (0.35) OGACYP2C9CYP2C19
SCHEMBL22928421 0.73 GBA1 (0.34) 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
WO-2021015622-A1 SYNTHESIS OF 6-AZIDO-6-DEOXY-2-N-ACETYL-HEXOSAMINE-NUCLEOSIDE DIPHOSPHATE SYNAFFIX B.V. (NL) 2021-01-28 WO disclosed