SCHEMBL4038240

SCHEMBL4038240

CCNCCNCc1ccc2nc(Nc3c(C)cccc3Cl)c3cncn3c2n1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.61
SRC P12931 1/20 0.55

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
SCHEMBL4045072 0.94 LCK (0.54) LCKSRC
SCHEMBL4043263 0.91 LCK (0.56) LCKSRC
SCHEMBL4039035 0.91 LCK (0.58) LCKSRC
SCHEMBL4037499 0.84 LCK (0.56) LCKSRC
SCHEMBL4039834 0.84 LCK (0.56) LCKSRC
SCHEMBL4038056 0.84 LCK (0.56) LCKSRC
SCHEMBL4040554 0.84 LCK (0.53) LCKSRC
SCHEMBL4039646 0.84 LCK (0.54) LCKSRC
SCHEMBL4038238 0.83 LCK (0.58) LCKSRC
SCHEMBL4039987 0.82 LCK (0.71) 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 disclosed
US-5990109-A NOVEL COMPOUNDS, METHODS OF THEIR SYNTHESIS, AND THEIR USE IN TREATING VARIOUS TYROSINE KINASE-ASSOCIATED IMMUNOLOGICAL DISORDERS, SUCH AS RHEUMATOID ARTHRITIS, MULTIPLE SCLEROSIS, GRAFT VS. HOST DISEASE, LUPUS, PSORIASIS AND ASTHMA BRISTOL-MYERS SQUIBB CO. (US) 1999-11-23 US disclosed