SCHEMBL1047826

SCHEMBL1047826

Cn1cc(-c2cnc(Nc3ccc(C(=O)Nc4ccccc4)cc3)c3c(=O)[nH]ccc23)cn1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 1/20 0.64
AURKB Q96GD4 10/20 0.50
EGFR P00533 3/20 0.50
INCENP Q9NQS7 1/20 0.50
CECR2 Q9BXF3 1/20 0.47
ROCK1 Q13464 1/20 0.47
AURKA O14965 3/20 0.44
KDR P35968 2/20 0.44
FGFR1 P11362 2/20 0.43
BRD4 O60885 2/20 0.42
CSF1R P07333 1/20 0.41
MAPK13 O15264 1/20 0.41
CHEK2 O96017 1/20 0.41
NTRK1 P04629 1/20 0.41
RET P07949 1/20 0.41
HCK P08631 1/20 0.41
FLT4 P35916 1/20 0.41
LIMK1 P53667 1/20 0.41
SIK1 P57059 1/20 0.41
TNK2 Q07912 1/20 0.41

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
SCHEMBL1045612 0.90 ZAP70 (0.73) ZAP70AURKBINCENPAURKAKDR
SCHEMBL1048228 0.85 ZAP70 (0.63) ZAP70AURKBINCENPROCK1AURKA
SCHEMBL1049582 0.82 ZAP70 (0.73) ZAP70AURKBINCENPAURKABRD4
SCHEMBL1046554 0.81 ZAP70 (0.77) ZAP70CECR2BRD4BTK
SCHEMBL1045544 0.78 ZAP70 (1.00) ZAP70MAPK13
SCHEMBL1049635 0.77 ZAP70 (0.53) ZAP70AURKBEGFRINCENPROCK1
SCHEMBL1048920 0.77 CDC7 (0.53) ZAP70AURKBEGFRINCENPAURKA
SCHEMBL1048390 0.76 ZAP70 (0.54) ZAP70BRD4
SCHEMBL1047378 0.75 ZAP70 (0.56) ZAP70AURKBAURKABRD4
SCHEMBL1046603 0.74 ZAP70 (0.53) ZAP70EGFR

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 14 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
CN-101990539-A Compounds and compositions as kinase inhibitors IRM LLC 2011-03-23 CN 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 4/4885AURKB 699/4885EGFR 237/4885

“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.