SCHEMBL1048534

SCHEMBL1048534

Cc1cc(Nc2nc(-c3cnn(CC(C)C)c3)cc3cc[nH]c(=O)c23)ccc1C1CCNCC1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 13/20 0.65
SYK P43405 3/20 0.42
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
AXL P30530 3/20 0.39
TYRO3 Q06418 3/20 0.39
MERTK Q12866 3/20 0.39

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
SCHEMBL1157987 0.91 ZAP70 (0.72) ZAP70SYKJAK2JAK1AXL
SCHEMBL1048726 0.89 ZAP70 (0.80) ZAP70SYKJAK2JAK1AXL
SCHEMBL1045642 0.88 ZAP70 (0.64) ZAP70SYKJAK2JAK1
SCHEMBL1047921 0.82 ZAP70 (0.79) ZAP70SYK
SCHEMBL1046606 0.82 ZAP70 (0.68) ZAP70SYKJAK2JAK1AXL
SCHEMBL1047856 0.81 ZAP70 (0.78) ZAP70SYK
SCHEMBL1048639 0.81 ZAP70 (0.83) ZAP70SYKJAK1
SCHEMBL1048657 0.80 ZAP70 (0.63) ZAP70SYK
SCHEMBL12874370 0.80 ZAP70 (0.60) ZAP70SYK
SCHEMBL1049627 0.79 ZAP70 (0.65) ZAP70JAK2JAK1AXLTYRO3

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 11 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
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 2/4885JAK2 63/4885

“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.