SCHEMBL18922681

SCHEMBL18922681

CCCC(=O)N1CC[C@@H](O)[C@@H]1CO

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 5/20 0.44
▸ GBA2 Q9HCG7 6/20 0.41
▸ HCRTR2 O43614 1/20 0.37
▸ GAA P10253 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ CHRNB2 P17787 1/20 0.35
▸ CHRNA3 P32297 1/20 0.35
▸ CHRNA4 P43681 1/20 0.35
▸ CHRNB3 Q05901 1/20 0.35
▸ CHRNA6 Q15825 1/20 0.35
▸ UGCG Q16739 1/20 0.33

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
SCHEMBL15372290 1.00 GBA1 (0.44) GBA1GBA2HCRTR2GAATHRB
SCHEMBL13032050 0.86 GBA1 (0.42) GBA1GBA2GAATHRB
SCHEMBL11992501 0.79 DPP4 (0.42) GBA1GBA2GAATHRB
SCHEMBL15186923 0.78 GBA1 (0.42) GBA1GBA2GAATHRB
SCHEMBL3360203 0.78 GBA1 (0.42) GBA1GBA2GAATHRB
SCHEMBL3360199 0.78 GBA1 (0.42) GBA1GBA2GAATHRB
SCHEMBL13942058 0.78 GBA1 (0.42) GBA1GBA2GAATHRB
SCHEMBL4258808 0.77 CHRNB2 (0.36) GBA1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL4248760 0.77 CHRNB2 (0.36) GBA1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL4259086 0.77 CHRNB2 (0.36) GBA1CHRNB2CHRNA3CHRNA4CHRNB3

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
US-9670195-B2 Glycosidase inhibitors and uses thereof ALECTOS THERAPEUTICS INC. (CA) 2017-06-06 — — US disclosed
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