SCHEMBL1043309

SCHEMBL1043309

Cc1ncc(-c2cc3cc[nH]c(=O)c3c(Nc3cccc(OCCN4CCOCC4)c3)n2)cn1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 11/20 0.54
SYK P43405 3/20 0.49
PRKCQ Q04759 2/20 0.47
SRC P12931 1/20 0.46
EGFR P00533 1/20 0.46
BTK Q06187 1/20 0.46
ACHE P22303 1/20 0.45
AIMP2 Q13155 1/20 0.45

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
SCHEMBL1045575 0.93 ZAP70 (0.52) ZAP70SYKPRKCQSRCEGFR
SCHEMBL1046940 0.91 ZAP70 (0.56) ZAP70SYK
SCHEMBL1048305 0.90 SRC (0.48) ZAP70SYKPRKCQSRCEGFR
SCHEMBL1048293 0.88 ZAP70 (0.57) ZAP70SYK
SCHEMBL1044839 0.87 ZAP70 (0.66) ZAP70SYKPRKCQSRCEGFR
SCHEMBL1047928 0.86 ZAP70 (0.49) ZAP70SYKPRKCQSRCEGFR
SCHEMBL1047984 0.86 ZAP70 (0.45) ZAP70SYKPRKCQSRCAIMP2
SCHEMBL1047830 0.86 ZAP70 (0.55) ZAP70SYKPRKCQSRCEGFR
SCHEMBL1045840 0.85 ZAP70 (0.56) ZAP70SYKACHE
SCHEMBL1047916 0.85 ZAP70 (0.65) ZAP70SYKPRKCQSRCEGFR

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
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 2/4885PRKCQ 73/4885

“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.