SCHEMBL2126982

SCHEMBL2126982

CCn1nc(Nc2ncc(Cl)c(Nc3cccc(F)c3NS(C)(=O)=O)n2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 8/20 0.46
MET P08581 3/20 0.46
GLO1 Q04760 1/20 0.44
CCNA2 P20248 2/20 0.42
CDK2 P24941 2/20 0.42
EGFR P00533 6/20 0.41
CCNK O75909 1/20 0.41
CCND3 P30281 1/20 0.41
CDK9 P50750 1/20 0.41
CDK6 Q00534 1/20 0.41
INSR P06213 2/20 0.41
LRRK2 Q5S007 1/20 0.41
FLT3 P36888 1/20 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
SCHEMBL2126616 0.89 GLO1 (0.45) ALKMETGLO1CCNA2CDK2
SCHEMBL2125821 0.87 ALK (0.56) ALKMETGLO1EGFRLRRK2
SCHEMBL2128811 0.86 GLO1 (0.44) ALKMETGLO1CCNA2CDK2
SCHEMBL2143511 0.83 GLO1 (0.46) ALKMETGLO1CCNA2CDK2
SCHEMBL2122602 0.83 ALK (0.42) ALKMETGLO1EGFRLRRK2
SCHEMBL2126996 0.79 ALK (0.53) ALKMETGLO1EGFRLRRK2
SCHEMBL1460877 0.78 ALK (0.45) ALKMETGLO1CCNA2CDK2
SCHEMBL2124144 0.78 JAK2 (0.58) ALKMETGLO1CDK2CDK9
SCHEMBL604128 0.76 PTK2 (0.49) ALKMETGLO1EGFRLRRK2
SCHEMBL600999 0.76 ALK (0.47) ALKMETGLO1LRRK2

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
US-20120172384-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2012-07-05 US claimed
US-20120172384-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2012-07-05 US disclosed
EP-2443106-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS Cellzome Limited (GB) 2012-04-25 EP disclosed
WO-2010146133-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2010-12-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120172384-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS ZAP70, JAK3, JAK2 ALK 233/4885MET 2363/4885GLO1 3371/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.