SCHEMBL1048073

SCHEMBL1048073

CCCS(=O)(=O)c1ccccc1Nc1cc2cc[nH]c(=O)c2c(Nc2ccc(C3CCNCC3)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 11/20 0.44
ALK Q9UM73 3/20 0.44
JAK1 P23458 2/20 0.40
JAK2 O60674 3/20 0.40
FER P16591 1/20 0.39
TYK2 P29597 1/20 0.37
ADRA2C P18825 2/20 0.37
ADRA1D P25100 2/20 0.37
ADRA1A P35348 2/20 0.37
ADRA1B P35368 2/20 0.37
LYN P07948 2/20 0.36
SYK P43405 2/20 0.36
KCNH2 Q12809 2/20 0.36
FLT3 P36888 1/20 0.36

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
SCHEMBL1048284 0.88 ZAP70 (0.51) ZAP70ALKJAK1JAK2FER
SCHEMBL1048072 0.87 ALK (0.58) ZAP70ALKKCNH2
SCHEMBL1047972 0.83 ZAP70 (0.45) ZAP70ALKJAK1JAK2FER
SCHEMBL1045667 0.83 ZAP70 (0.47) ZAP70ALKJAK1JAK2FER
SCHEMBL3358977 0.82 ZAP70 (0.51) ZAP70JAK1JAK2FERTYK2
SCHEMBL1047730 0.81 ZAP70 (0.67) ZAP70JAK1JAK2TYK2SYK
SCHEMBL1048359 0.80 ZAP70 (0.55) ZAP70JAK1JAK2SYK
SCHEMBL1048578 0.79 ZAP70 (0.58) ZAP70ALKJAK1JAK2FER
SCHEMBL1048755 0.79 ZAP70 (0.58) ZAP70JAK2FERTYK2LYN
SCHEMBL1048111 0.79 ZAP70 (0.57) ZAP70ALKJAK1JAK2FER

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 4/4885ALK 9/4885JAK1 90/4885

“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.