SCHEMBL628243

SCHEMBL628243

Ic1cnc2sc(NC3CCOCC3)nn12

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FYN P06241 16/20 0.46
HASPIN Q8TF76 1/20 0.42
MAPK1 P28482 3/20 0.39
MKNK1 Q9BUB5 1/20 0.39

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
SCHEMBL625117 0.84 FYN (0.42) FYNHASPINMKNK1
SCHEMBL626175 0.83 FYN (0.46) FYNHASPINMKNK1
SCHEMBL627199 0.83 FYN (0.46) FYNHASPINMKNK1
SCHEMBL627849 0.81 FYN (0.46) FYNHASPINMKNK1
SCHEMBL627017 0.81 FYN (0.47) FYNHASPIN
SCHEMBL627018 0.81 FYN (0.47) FYNHASPIN
SCHEMBL627384 0.78 FYN (0.48) FYNHASPINMKNK1
SCHEMBL627167 0.78 FYN (0.46) FYNHASPIN
SCHEMBL2254820 0.75 FYN (0.60) FYNHASPINMKNK1
SCHEMBL627106 0.74 FYN (0.44) FYNHASPIN

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-2012020217-A1 AMINO- IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN OR LIPID KINASE INHIBITORS CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) 2012-02-16 WO disclosed