SCHEMBL5017367

SCHEMBL5017367

COc1cc(-c2csc3c(C(=O)NCN4CCOCC4)cnc(N)c23)ccc1NC(=O)c1cc2ccccc2n1C

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.79
HCK P08631 14/20 0.79
FYN P06241 2/20 0.66
LYN P07948 2/20 0.66
FGR P09769 2/20 0.66
SRC P12931 2/20 0.66
TEK Q02763 1/20 0.66

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
SCHEMBL5017604 0.94 LCK (0.89) LCKHCKFYNLYNFGR
Acetic Acid SCHEMBL5017593 0.92 LCK (0.78) LCKHCKFYNLYNFGR
SCHEMBL3526861 0.88 LCK (0.82) LCKHCKFYNLYNFGR
SCHEMBL5025702 0.88 LCK (0.86) LCKHCKFYNLYNFGR
SCHEMBL3527984 0.88 LCK (0.89) LCKHCKFYNLYNFGR
SCHEMBL3530173 0.87 LCK (0.89) LCKHCKFYNLYNFGR
SCHEMBL3528483 0.87 LCK (1.00) LCKHCKFYNLYNFGR
SCHEMBL5016877 0.87 LCK (0.85) LCKHCKFYNLYNFGR
SCHEMBL3529696 0.87 LCK (0.81) LCKHCKFYNLYNFGR
SCHEMBL3530810 0.87 LCK (0.88) LCKHCKFYNLYNFGR

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-1648905-B1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABBOTT LAB (US) 2008-12-31 EP disclosed