SCHEMBL1048355

SCHEMBL1048355

COc1ccccc1Nc1nc(-c2cccc(N3CCCC3)c2)cc2cc[nH]c(=O)c12

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 9/20 0.54
IGF1R P08069 1/20 0.43
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
MAPT P10636 2/20 0.43
EGFR P00533 4/20 0.42
JAK2 O60674 2/20 0.42
RXFP1 Q9HBX9 1/20 0.41
JAK1 P23458 1/20 0.41
USP2 O75604 1/20 0.40
HTR7 P34969 1/20 0.39
APAF1 O14727 1/20 0.39
NPC1 O15118 1/20 0.39
PTBP1 P26599 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL1047094 0.91 ZAP70 (0.51) ZAP70IGF1REGFRRXFP1
SCHEMBL1050508 0.91 ZAP70 (0.51) ZAP70ALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL1048223 0.88 ZAP70 (0.56) ZAP70EGFRJAK2
SCHEMBL1048401 0.87 ZAP70 (0.48) ZAP70IGF1RJAK2
SCHEMBL1048705 0.73 ZAP70 (0.84) ZAP70JAK2
SCHEMBL1047757 0.73 ZAP70 (0.51) ZAP70JAK2
SCHEMBL27826703 0.73 ZAP70 (0.58) ZAP70EGFRHTR7
SCHEMBL1048673 0.73 ZAP70 (0.51) ZAP70
SCHEMBL1048185 0.73 ZAP70 (0.78) ZAP70JAK2
SCHEMBL1047272 0.72 ZAP70 (0.57) ZAP70IGF1R

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 9 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
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP claimed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO claimed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
CN-101990539-A Compounds and compositions as kinase inhibitors IRM LLC 2011-03-23 CN 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 4/4885IGF1R 236/4885ALDH1A1 2562/4885

“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.