SCHEMBL625540

SCHEMBL625540

CN(C)c1cccc(-c2cnc3sc(NC4CC5(CCNCC5)C4)nn23)c1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FYN P06241 19/20 0.68
HASPIN Q8TF76 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
SCHEMBL624978 0.84 FYN (0.51) FYNHASPIN
SCHEMBL625548 0.83 FYN (0.52) FYN
SCHEMBL625243 0.83 FYN (0.60) FYN
SCHEMBL625541 0.82 FYN (0.47) FYN
SCHEMBL625560 0.81 FYN (0.50) FYN
SCHEMBL1944343 0.81 FYN (1.00) FYNHASPIN
SCHEMBL626107 0.75 PIK3CA (0.48) FYNHASPIN
SCHEMBL1944077 0.72 FYN (0.71) FYN
SCHEMBL1948058 0.71 FYN (0.72) FYN
SCHEMBL1946621 0.71 FYN (0.63) FYN

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