SCHEMBL4040593

SCHEMBL4040593

Cc1cccc(Cl)c1Nc1nc2ccc(N3CC(C)NC(C)C3)nc2n2cncc12

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.83
SRC P12931 1/20 0.83

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
SCHEMBL4036450 0.95 LCK (0.74) LCKSRC
SCHEMBL4036276 0.94 LCK (0.72) LCKSRC
SCHEMBL4037788 0.91 LCK (1.00) LCKSRC
SCHEMBL4036209 0.91 LCK (1.00) LCKSRC
SCHEMBL4036207 0.91 LCK (1.00) LCKSRC
SCHEMBL4038843 0.90 LCK (0.76) LCKSRC
SCHEMBL4038248 0.90 LCK (0.67) LCKSRC
SCHEMBL4038701 0.89 LCK (0.74) LCKSRC
SCHEMBL4036075 0.87 LCK (0.76) LCKSRC
SCHEMBL4038483 0.86 LCK (0.75) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1620437-B1 5,7-DIAMINOPYRAZOLO¬4,3-D PYRIMIDINES USEFUL IN THE TRAETMENT OF HYPERTENSION PFIZER LTD (GB) 2009-06-17 EP claimed
EP-1066286-B1 HETEROCYCLO-SUBSTITUTED IMIDAZOPYRAZINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2009-04-29 EP claimed
EP-1549655-B1 SUBSTITUTED BICYCLIC THIOPHENE DERIVATIVES, COMPOSTIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK & CO INC (US) 2009-01-21 EP claimed
EP-1066286-B1 HETEROCYCLO-SUBSTITUTED IMIDAZOPYRAZINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2009-04-29 EP disclosed