SCHEMBL6460593

SCHEMBL6460593

Nc1ncnc2c1c(-c1ccc(NS(=O)(=O)c3ccc(F)cc3)c(F)c1)cn2C1CCNCC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EIF2AK3 Q9NZJ5 1/20 0.58
FGR P09769 1/20 0.54
EPHA1 P21709 1/20 0.54
TXK P42681 1/20 0.54
FRK P42685 1/20 0.54
PTK6 Q13882 1/20 0.54
TEK Q02763 2/20 0.54
RIPK2 O43353 2/20 0.54
NEK7 Q8TDX7 10/20 0.52
SRC P12931 3/20 0.51
LCK P06239 1/20 0.51
ABL1 P00519 2/20 0.49
EGFR P00533 2/20 0.49
ABL2 P42684 2/20 0.49
MEN1 O00255 2/20 0.49

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
SCHEMBL6463833 0.88 TEK (0.56) EIF2AK3TEKRIPK2NEK7MEN1
SCHEMBL12934107 0.88 TEK (0.58) TEKRIPK2NEK7SRCLCK
SCHEMBL6459716 0.87 TEK (0.73) EIF2AK3PTK6TEKRIPK2NEK7
SCHEMBL6465140 0.87 TEK (0.73) EIF2AK3PTK6TEKRIPK2NEK7
SCHEMBL6459712 0.87 TEK (0.73) EIF2AK3PTK6TEKRIPK2NEK7
SCHEMBL12934129 0.86 TEK (0.65) TEKRIPK2NEK7SRCLCK
SCHEMBL2074511 0.85 RIPK2 (0.54) EIF2AK3TEKRIPK2NEK7SRC
SCHEMBL6460259 0.85 TEK (0.56) EIF2AK3TEKRIPK2NEK7MEN1
SCHEMBL6466879 0.84 FGR (0.54) EIF2AK3FGREPHA1TXKFRK
SCHEMBL6466010 0.83 TEK (0.53) EIF2AK3TEKRIPK2NEK7MEN1

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 10 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
CN-1335849-A Pyrrolopyrimidines as protein kinase inhibitors BASF AG (DE) 2002-02-13 CN claimed
US-20050008640-A1 Method of treating transplant rejection ABBOTT LABORATORIES 2005-01-13 US disclosed
WO-2004100868-A2 METHOD OF TREATING TRANSPLANT REJECTION ABBOTT LABORATORIES (US) 2004-11-25 WO 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
WO-2001072751-A1 PYRROLOPYRIMIDINES AS TYROSINE KINASE INHIBITORS KNOLL GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2001-10-04 WO disclosed
EP-1114053-A1 PYRROLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-07-11 EP disclosed
WO-2000017203-A1 PYRROLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-03-30 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 (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 EIF2AK3 3756/4885FGR 334/4885EPHA1 1497/4885
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents FLT1, FLT4, TFPI EIF2AK3 928/4885FGR 283/4885EPHA1 2762/4885

“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.