SCHEMBL6466879

SCHEMBL6466879

Nc1ncnc2c1c(-c1ccc(NS(=O)(=O)c3cccc(Cl)c3Cl)c(F)c1)cn2C1CCNCC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
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
EIF2AK3 Q9NZJ5 6/20 0.53
SRC P12931 3/20 0.49
TEK Q02763 2/20 0.49
LCK P06239 1/20 0.49
RIPK2 O43353 3/20 0.49
ABL1 P00519 2/20 0.49
EGFR P00533 2/20 0.49
ABL2 P42684 2/20 0.49
NEK7 Q8TDX7 6/20 0.48

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
SCHEMBL2074338 0.93 EIF2AK3 (0.53) EIF2AK3SRCTEKLCKRIPK2
SCHEMBL6459150 0.91 EIF2AK3 (0.52) EIF2AK3TEKRIPK2NEK7
SCHEMBL6461797 0.88 TEK (0.64) PTK6EIF2AK3SRCTEKLCK
SCHEMBL30527006 0.88 TEK (0.64) PTK6EIF2AK3SRCTEKLCK
SCHEMBL14183076 0.88 TEK (0.64) PTK6EIF2AK3SRCTEKLCK
SCHEMBL6461798 0.88 TEK (0.64) PTK6EIF2AK3SRCTEKLCK
SCHEMBL6460401 0.87 EIF2AK3 (0.49) EIF2AK3SRCTEKLCKRIPK2
SCHEMBL2074412 0.87 EGFR (0.54) EIF2AK3SRCTEKLCKRIPK2
SCHEMBL2074616 0.86 EIF2AK3 (0.54) EIF2AK3SRCTEKLCKRIPK2
SCHEMBL6460593 0.84 EIF2AK3 (0.58) FGREPHA1TXKFRKPTK6

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-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

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 FGR 334/4885EPHA1 1497/4885TXK 492/4885
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents FLT1, FLT4, TFPI FGR 283/4885EPHA1 2762/4885TXK 135/4885

“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.