SCHEMBL11114311

SCHEMBL11114311

CC1CN(C2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC(C)O1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CDA P32320 7/20 0.46
▸ LGALS1 P09382 2/20 0.39
▸ LGALS3 P17931 2/20 0.39
▸ LGALS9 O00182 1/20 0.39
▸ LGALS8 O00214 1/20 0.39
▸ GAA P10253 1/20 0.38
▸ PYGB P11216 1/20 0.38

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
SCHEMBL11707269 0.80 CDA (0.55) CDALGALS1LGALS3LGALS9LGALS8
SCHEMBL11433490 0.75 CDA (0.55) CDALGALS1LGALS3LGALS9LGALS8
SCHEMBL15297983 0.75 CDA (0.55) CDALGALS1LGALS3LGALS9LGALS8
SCHEMBL19856460 0.72 CDA (0.60) CDA
SCHEMBL19856471 0.72 CDA (0.60) CDA
SCHEMBL18851813 0.72 CDA (0.60) CDA
SCHEMBL12374625 0.72 CDK1 (0.42) CDALGALS1LGALS3LGALS9LGALS8
SCHEMBL31017612 0.68 CDA (0.58) CDA
SCHEMBL13996793 0.67 LGALS3 (0.64) LGALS1LGALS3LGALS9LGALS8GAA
SCHEMBL17621600 0.67 LGALS3 (0.64) LGALS1LGALS3LGALS9LGALS8GAA

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-0119539-A2 Fungicidal agent, substituted glucopyranosyl amine and a method of combating moulds BASF Aktiengesellschaft (DE) 1984-09-26 — — EP claimed
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