SCHEMBL9221292

SCHEMBL9221292

CC(=O)NC1(C)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 8/20 0.48
▸ OGA O60502 1/20 0.40
▸ PYGL P06737 3/20 0.40
▸ PYGM P11217 2/20 0.40
▸ TSHR P16473 1/20 0.35

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
SCHEMBL15284881 0.81 PYGB (0.49) PYGBOGAPYGLPYGMTSHR
SCHEMBL29406981 0.81 PYGB (0.49) PYGBOGAPYGLPYGMTSHR
SCHEMBL28379664 0.81 PYGB (0.49) PYGBOGAPYGLPYGMTSHR
SCHEMBL1674154 0.81 PYGB (0.49) PYGBOGAPYGLPYGMTSHR
SCHEMBL29484208 0.81 PYGB (0.49) PYGBOGAPYGLPYGMTSHR
SCHEMBL10357870 0.80 PYGB (0.51) PYGBOGAPYGLPYGMTSHR
SCHEMBL30569120 0.72 PYGB (0.43) PYGBOGAPYGLPYGMTSHR
SCHEMBL31598843 0.72 PYGB (0.43) PYGBOGAPYGLPYGMTSHR
SCHEMBL20677443 0.71 PYGB (0.37) PYGBPYGLPYGMTSHR
SCHEMBL9448378 0.71 PYGB (0.44) PYGBOGAPYGLPYGM

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-1995003809-A2 USE OF GLUCOKINASE INHIBITORS FOR THE MANUFACTURE OF A MEDICAMENT FOR TREATING TUMOURS ISIS INNOVATION LIMITED (GB) 1995-02-09 — — WO disclosed
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