SCHEMBL4036346

SCHEMBL4036346

CC(=O)N(C)C1CCN(c2ccc3nc(Nc4c(C)cccc4Cl)c4cncn4c3n2)C1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LCK P06239 19/20 0.67
SRC P12931 1/20 0.67
LYN P07948 1/20 0.48
BTK Q06187 1/20 0.48

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
SCHEMBL4040325 0.91 LCK (0.73) LCKSRC
SCHEMBL4036351 0.86 LCK (0.69) LCKSRC
SCHEMBL4039733 0.86 LCK (0.75) LCKSRC
SCHEMBL4037424 0.86 LCK (0.75) LCKSRC
SCHEMBL4041102 0.84 LCK (0.68) LCKSRC
SCHEMBL4038195 0.84 LCK (0.75) LCKSRC
SCHEMBL4039788 0.84 LCK (0.75) LCKSRC
SCHEMBL4045378 0.84 LCK (0.72) LCKSRC
SCHEMBL4038851 0.83 LCK (0.69) LCKSRC
SCHEMBL4036075 0.83 LCK (0.76) LCKSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066286-B1 HETEROCYCLO-SUBSTITUTED IMIDAZOPYRAZINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2009-04-29 EP claimed
EP-1066286-B1 HETEROCYCLO-SUBSTITUTED IMIDAZOPYRAZINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2009-04-29 EP disclosed