SCHEMBL1047739

SCHEMBL1047739

Cn1cc(-c2cc3cc[nH]c(=O)c3c(Nc3ccc(C4CCN(CCO)CC4)cc3)n2)cn1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 15/20 0.65
SYK P43405 2/20 0.41
JAK2 O60674 1/20 0.41
MAP4K1 Q92918 2/20 0.40
MAP4K3 Q8IVH8 1/20 0.40
JAK1 P23458 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
SCHEMBL1047309 0.92 ZAP70 (0.67) ZAP70SYKMAP4K1MAP4K3JAK1
SCHEMBL1048610 0.90 ZAP70 (0.79) ZAP70MAP4K1MAP4K3JAK1
SCHEMBL1044350 0.88 ZAP70 (0.79) ZAP70SYKJAK1
SCHEMBL12849100 0.87 ZAP70 (0.67) ZAP70JAK2JAK1
SCHEMBL1046571 0.87 ZAP70 (0.66) ZAP70SYKJAK2JAK1
SCHEMBL1046577 0.86 ZAP70 (0.61) ZAP70SYKJAK2JAK1
SCHEMBL1049650 0.86 ZAP70 (0.66) ZAP70SYKMAP4K1MAP4K3
SCHEMBL1043245 0.86 ZAP70 (0.66) ZAP70SYKJAK2
SCHEMBL12929754 0.84 ZAP70 (0.66) ZAP70SYKJAK2
SCHEMBL1045360 0.84 ZAP70 (0.67) ZAP70SYKMAP4K1JAK1

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 8 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

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.