SCHEMBL22757443

SCHEMBL22757443

CNC(=O)C1CC[C@H](C)OC1C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
CHRNA7 P36544 1/20 0.33
GRM4 Q14833 1/20 0.33
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 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
SCHEMBL354194 0.75 CHRNB2 (0.31) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL22757353 0.75 CHRNB2 (0.31) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL22757355 0.75 CHRNB2 (0.31) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL16840685 0.71
SCHEMBL12141594 0.71
SCHEMBL16440239 0.71
SCHEMBL16840700 0.71
SCHEMBL16440237 0.71
SCHEMBL16840688 0.71
SCHEMBL16840690 0.71

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-2020247546-A1 ADENOSINE ANALOGS FOR THE TREATMENT OF DISEASE BIOINTERVENE, INC. (US) 2020-12-10 WO disclosed