SCHEMBL4038784

SCHEMBL4038784

Cc1cccc(C)c1Nc1nc2ccc(N(C)C[C@H](O)CO)nc2n2cncc12

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LCK P06239 18/20 0.51
SRC P12931 2/20 0.44
LYN P07948 1/20 0.43
BTK Q06187 1/20 0.43

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
SCHEMBL4036241 1.00 LCK (0.51) LCKSRCLYNBTK
SCHEMBL4036352 1.00 LCK (0.51) LCKSRCLYNBTK
SCHEMBL4036283 0.94 LCK (0.56) LCKSRC
SCHEMBL4037493 0.94 LCK (0.56) LCKSRC
SCHEMBL4039824 0.94 LCK (0.56) LCKSRC
SCHEMBL4037815 0.90 LCK (0.48) LCKSRCLYNBTK
SCHEMBL4039642 0.87 LCK (0.54) LCKSRCLYNBTK
SCHEMBL4036190 0.85 LCK (0.53) LCKSRC
SCHEMBL4040544 0.83 LCK (0.50) LCKSRCLYNBTK
SCHEMBL4036713 0.82 LCK (0.55) 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 3 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-1230243-B1 POYCYLOALKYLPURINES AS ADENOSINE RECEPTOR ANTAGONISTS BIOGEN IDEC INC (US) 2009-03-04 EP claimed
EP-1066286-B1 HETEROCYCLO-SUBSTITUTED IMIDAZOPYRAZINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2009-04-29 EP disclosed