SCHEMBL6464384

SCHEMBL6464384

Cc1nc(S(=O)(=O)N2CCC(n3cc(-c4ccc(NS(=O)(=O)c5ccc(F)cc5)c(F)c4)c4c(N)ncnc43)CC2)cn1C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TEK Q02763 1/20 0.52
EIF2AK3 Q9NZJ5 10/20 0.49
NEK7 Q8TDX7 3/20 0.48
MEN1 O00255 3/20 0.47
RIPK2 O43353 2/20 0.45
EGFR P00533 1/20 0.45
ERBB2 P04626 1/20 0.45
IGF1R P08069 1/20 0.45
ERBB3 P21860 1/20 0.45
ERBB4 Q15303 1/20 0.45

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
SCHEMBL6466010 0.90 TEK (0.53) TEKEIF2AK3NEK7MEN1RIPK2
SCHEMBL6459716 0.83 TEK (0.73) TEKEIF2AK3NEK7MEN1RIPK2
SCHEMBL6459712 0.83 TEK (0.73) TEKEIF2AK3NEK7MEN1RIPK2
SCHEMBL6465140 0.83 TEK (0.73) TEKEIF2AK3NEK7MEN1RIPK2
SCHEMBL6463833 0.83 TEK (0.56) TEKEIF2AK3NEK7MEN1RIPK2
SCHEMBL6460593 0.82 EIF2AK3 (0.58) TEKEIF2AK3NEK7MEN1RIPK2
SCHEMBL6466935 0.80 NEK7 (0.51) TEKEIF2AK3NEK7MEN1
SCHEMBL12934107 0.80 TEK (0.58) TEKNEK7MEN1RIPK2EGFR
SCHEMBL6460259 0.80 TEK (0.56) TEKEIF2AK3NEK7MEN1RIPK2
SCHEMBL14183079 0.80 TEK (0.72) TEKEIF2AK3NEK7RIPK2EGFR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713474-B2 SERINE-THREONINE AND TYROSINE KINASE INHIBITORS ABBOTT GMBH & CO. KG (DE) 2004-03-30 US claimed
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-08-14 US claimed
US-20050008640-A1 Method of treating transplant rejection ABBOTT LABORATORIES 2005-01-13 US disclosed
US-6713474-B2 SERINE-THREONINE AND TYROSINE KINASE INHIBITORS ABBOTT GMBH & CO. KG (DE) 2004-03-30 US disclosed
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-08-14 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 (2 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-20050008640-A1 Method of treating transplant rejection LCK, ZAP70, FYN TEK 1465/4885EIF2AK3 3756/4885NEK7 3001/4885
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents FLT1, FLT4, TFPI TEK 22/4885EIF2AK3 928/4885NEK7 1848/4885

“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.