SCHEMBL7629596

SCHEMBL7629596

Cc1cccc(C)c1NC(=O)c1ccc2nc(NCC(C)C=O)sc2c1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.71
FYN P06241 2/20 0.54
SRC P12931 2/20 0.54

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
SCHEMBL7629214 0.94 LCK (0.66) LCKFYNSRC
SCHEMBL7628908 0.92 LCK (0.71) LCK
SCHEMBL7634339 0.87 LCK (0.61) LCKFYNSRC
SCHEMBL6058071 0.83 LCK (1.00) LCKFYNSRC
SCHEMBL7629135 0.81 LCK (0.67) LCKFYNSRC
SCHEMBL6057832 0.81 LCK (0.79) LCKFYNSRC
SCHEMBL7632719 0.81 LCK (0.64) LCKFYNSRC
SCHEMBL7626053 0.81 LCK (0.61) LCKFYNSRC
SCHEMBL7622018 0.81 LCK (0.65) LCK
SCHEMBL7627253 0.79 LCK (0.67) LCK

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1037632-A4 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2002-08-21 EP disclosed
EP-1037632-A1 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-09-27 EP disclosed
WO-1999024035-A1 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-05-20 WO disclosed