SCHEMBL1049149

SCHEMBL1049149

CNC(=O)C(C)(C)c1ccc(Nc2nc(-c3cncc(S(C)(=O)=O)c3)cc3cc[nH]c(=O)c23)cc1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 16/20 0.77
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
TYK2 P29597 1/20 0.35
JAK1 P23458 2/20 0.34
JAK2 O60674 1/20 0.34

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
SCHEMBL1045387 0.88 ZAP70 (0.59) ZAP70BRD4CREBBPTYK2JAK1
SCHEMBL1048334 0.87 ZAP70 (1.00) ZAP70TYK2
SCHEMBL1049894 0.83 ZAP70 (0.82) ZAP70TYK2
SCHEMBL1049893 0.82 ZAP70 (0.80) ZAP70TYK2
SCHEMBL1048546 0.81 ZAP70 (0.73) ZAP70TYK2
SCHEMBL1044227 0.81 ZAP70 (0.52) ZAP70BRD4CREBBPJAK1JAK2
SCHEMBL1049022 0.81 ZAP70 (0.58) ZAP70TYK2JAK1JAK2
SCHEMBL1045355 0.80 ZAP70 (0.51) ZAP70BRD4CREBBP
SCHEMBL1083418 0.80 ZAP70 (0.57) ZAP70TYK2JAK1JAK2
SCHEMBL1047847 0.79 ZAP70 (0.49) ZAP70BRD4CREBBP

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 3 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

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 4/4885BRD4 2595/4885CREBBP 713/4885

“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.