SCHEMBL1048025

SCHEMBL1048025

CS(=O)(=O)c1cccc(-c2cc3cc[nH]c(=O)c3c(Nc3cccc(N4CCOCC4)c3)n2)c1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 12/20 0.67
JAK2 O60674 5/20 0.53
JAK3 P52333 5/20 0.53
PTK2 Q05397 4/20 0.53
TTBK1 Q5TCY1 1/20 0.47
TTBK2 Q6IQ55 1/20 0.47
PIK3CA P42336 1/20 0.43
PIK3CG P48736 1/20 0.43
KCNA5 P22460 1/20 0.42

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
SCHEMBL1049616 0.93 ZAP70 (0.67) ZAP70JAK2JAK3PTK2TTBK1
SCHEMBL1048935 0.93 ZAP70 (0.77) ZAP70JAK2JAK3PTK2
SCHEMBL1048705 0.89 ZAP70 (0.84) ZAP70JAK2TTBK1TTBK2
SCHEMBL1049006 0.85 ZAP70 (0.70) ZAP70TTBK1TTBK2
SCHEMBL1048879 0.85 ZAP70 (0.77) ZAP70JAK2JAK3
SCHEMBL1048884 0.83 ZAP70 (0.71) ZAP70JAK2JAK3PTK2
SCHEMBL1048154 0.83 ZAP70 (0.71) ZAP70
SCHEMBL1048810 0.81 ZAP70 (0.71) ZAP70
SCHEMBL1047684 0.81 ZAP70 (0.82) ZAP70JAK2
SCHEMBL1045880 0.81 ZAP70 (0.65) ZAP70JAK2

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 6 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-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 63/4885JAK3 212/4885

“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.