SCHEMBL2897071

SCHEMBL2897071

OCC[C@H]1CCNC[C@@H]1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 9/20 0.43
▸ GLB1 P16278 3/20 0.43
▸ GAA P10253 2/20 0.43
▸ PYGL P06737 1/20 0.43
▸ GBA2 Q9HCG7 1/20 0.43
▸ MAN1B1 Q9UKM7 1/20 0.36
▸ GLA P06280 2/20 0.33
▸ FUCA1 P04066 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
SCHEMBL29716692 0.82 — —
SCHEMBL462863 0.82 — —
SCHEMBL505753 0.82 — —
SCHEMBL1313595 0.82 — —
SCHEMBL505465 0.82 — —
SCHEMBL505752 0.82 — —
SCHEMBL462864 0.82 — —
SCHEMBL13906097 0.81 CA1 (0.52) GBA1GLB1GAAPYGLGBA2
SCHEMBL28316228 0.81 CA1 (0.52) GBA1GLB1GAAPYGLGBA2
SCHEMBL12561505 0.81 CA1 (0.52) GBA1GLB1GAAPYGLGBA2

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-2010506-B1 DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS HOFFMANN LA ROCHE (CH) 2010-08-04 — — EP disclosed
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