SCHEMBL4038830

SCHEMBL4038830

Cc1cccc(Cl)c1-c1nc(NCCN(C)C)cc2nc(N)c3cncn3c12

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LCK P06239 18/20 0.49
FGFR1 P11362 2/20 0.40
KDR P35968 2/20 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
SCHEMBL4041226 0.83 LCK (0.53) LCKFGFR1KDR
SCHEMBL4042263 0.82 LCK (0.47) LCKFGFR1KDR
SCHEMBL4041458 0.81 LCK (0.53) LCK
SCHEMBL7979958 0.78 LCK (0.56) LCK
SCHEMBL4043849 0.77 LCK (0.43) LCKFGFR1
SCHEMBL7982713 0.76 LCK (0.51) LCK
SCHEMBL4038826 0.75 FGFR1 (0.49) LCKFGFR1KDR
SCHEMBL4038945 0.74 LCK (0.50) LCK
SCHEMBL7983111 0.74 LCK (0.58) LCK
SCHEMBL4042434 0.71 LCK (0.41) LCKFGFR1

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