SCHEMBL9847743

SCHEMBL9847743

O=C1C=CC2=C(C1)CC(=O)N=C2

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40

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
SCHEMBL12505051 0.72 GSK3A (0.42) GSK3AGSK3B
SCHEMBL277815 0.61
SCHEMBL18706038 0.60 GSK3A (0.42) GSK3AGSK3B
SCHEMBL1239280 0.59
Hydrochloric Acid SCHEMBL9956679 0.58 GSK3A (0.39) GSK3AGSK3B
SCHEMBL5037294 0.57 GSK3A (0.39) GSK3AGSK3B
SCHEMBL17514063 0.57 GSK3A (0.39) GSK3AGSK3B
SCHEMBL366153 0.57 GSK3A (0.71) GSK3AGSK3B
SCHEMBL11666359 0.56
SCHEMBL9527717 0.54 GSK3A (0.46) GSK3AGSK3B

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-0431452-A2 Method for the optical distinction of dental materials and material used in this method IVOCLAR AG (LI) 1991-06-12 EP disclosed