SCHEMBL1047565

SCHEMBL1047565

CCn1ccc2cc(-c3cnc(N)nc3)nc(Nc3ccc(N4CCOCC4)cc3)c2c1=O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 8/20 0.53
SYK P43405 3/20 0.46
CD63 P08962 2/20 0.46
PIK3CA P42336 4/20 0.46
JAK2 O60674 1/20 0.44
PIK3CG P48736 2/20 0.43
PIK3CD O00329 1/20 0.43
PIK3CB P42338 1/20 0.43
MTOR P42345 1/20 0.43
PI4KB Q9UBF8 1/20 0.43
AKT1 P31749 1/20 0.42
GRM2 Q14416 2/20 0.42
CDK4 P11802 1/20 0.42
CCND1 P24385 1/20 0.42
CCND2 P30279 1/20 0.42
CCND3 P30281 1/20 0.42

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
SCHEMBL1047118 0.91 ZAP70 (0.52) ZAP70SYKCD63PIK3CAPIK3CG
SCHEMBL1048467 0.90 ZAP70 (0.51) ZAP70SYKCD63PIK3CAAKT1
SCHEMBL1049086 0.89 ZAP70 (0.51) ZAP70SYKCD63PIK3CAJAK2
SCHEMBL1046474 0.89 ZAP70 (0.51) ZAP70SYKCD63PIK3CAPIK3CG
SCHEMBL1049049 0.89 ZAP70 (0.51) ZAP70SYKCD63PIK3CAPIK3CG
SCHEMBL1046724 0.89 ZAP70 (0.68) ZAP70SYKCD63PIK3CAPIK3CG
SCHEMBL1159471 0.86 ZAP70 (0.46) ZAP70SYKCD63PIK3CAPIK3CG
SCHEMBL1047820 0.81 ZAP70 (0.51) ZAP70SYK
SCHEMBL1047913 0.81 ZAP70 (0.57) ZAP70SYKCD63
SCHEMBL1047909 0.80 ZAP70 (0.59) ZAP70SYKPIK3CAPIK3CGGRM2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US claimed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US claimed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP claimed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO claimed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 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-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FYN, SYK, RET ZAP70 4/4885SYK 2/4885CD63 1907/4885

“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.