SCHEMBL1050063

SCHEMBL1050063

COc1cncc(-c2cc3cc[nH]c(=O)c3c(Nc3ccc(C4CCN(CCC#N)CC4)cc3)n2)c1.O=C(Nc1ccccc1)c1ccc(Nc2nccc3cc[nH]c(=O)c23)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 12/20 0.66
JAK2 O60674 1/20 0.36
SYK P43405 1/20 0.36
EGFR P00533 1/20 0.36
ATR Q13535 1/20 0.36
ABCB1 P08183 2/20 0.35
CYP3A4 P08684 2/20 0.35
ABL1 P00519 2/20 0.34
BCR P11274 2/20 0.34
BTK Q06187 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
SCHEMBL1048857 0.88 ZAP70 (0.80) ZAP70JAK2SYK
SCHEMBL1045821 0.80 ZAP70 (1.00) ZAP70JAK2SYK
SCHEMBL1049401 0.78 ZAP70 (0.85) ZAP70JAK2SYK
SCHEMBL1047354 0.78 ZAP70 (0.81) ZAP70SYKEGFR
SCHEMBL1043305 0.78 ZAP70 (0.80) ZAP70JAK2SYK
SCHEMBL1049878 0.77 ZAP70 (0.77) ZAP70SYK
SCHEMBL1048840 0.77 ZAP70 (0.80) ZAP70SYKBTK
SCHEMBL1046871 0.76 ZAP70 (0.76) ZAP70
SCHEMBL1048148 0.75 ZAP70 (0.76) ZAP70SYKEGFR
Methanesulfonamide SCHEMBL27826799 0.75 ZAP70 (0.75) ZAP70SYK

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 4 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 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

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 4/4885JAK2 63/4885SYK 2/4885

“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.