SCHEMBL9529683

SCHEMBL9529683

NC1CC2=C(CC(=O)C=C2)C1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
FYN P06241 1/20 0.31

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
Hydrochloric Acid SCHEMBL11349506 0.76 GSK3A (0.33) GSK3AGSK3B
SCHEMBL7947539 0.75 GSK3A (0.40) GSK3AGSK3B
SCHEMBL7359397 0.65 MBTD1 (0.31) GSK3AGSK3B
SCHEMBL1200455 0.63 GSK3A (0.32) GSK3AGSK3B
SCHEMBL10381381 0.62 FYN (0.31) FYN
SCHEMBL9527717 0.62 GSK3A (0.46) GSK3AGSK3B
SCHEMBL943110 0.62 GSK3A (0.46) GSK3AGSK3B
SCHEMBL10790767 0.62 GSK3A (0.46) GSK3AGSK3B
SCHEMBL277815 0.61
SCHEMBL23095919 0.61

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-0299533-B1 HIGH POTENCY SWEETENING AGENTS THE NUTRASWEET COMPANY (a Delaware corporation) (US) 1993-04-07 EP disclosed