SCHEMBL6465401

SCHEMBL6465401

COc1cc(-c2cn(C3CCC(N4CCN(C)CC4)CC3)c3ncnc(N)c23)ccc1NC(=O)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 16/20 0.74
TEK Q02763 14/20 0.74
SRC P12931 14/20 0.74
KDR P35968 4/20 0.62
FYN P06241 3/20 0.62
LIMK1 P53667 3/20 0.62
HCK P08631 3/20 0.62
RET P07949 2/20 0.62
PLK4 O00444 2/20 0.62
PAK4 O96013 2/20 0.62
CHEK2 O96017 2/20 0.62
ABL1 P00519 2/20 0.62
EGFR P00533 2/20 0.62
ERBB2 P04626 2/20 0.62
NTRK1 P04629 2/20 0.62
INSR P06213 2/20 0.62
CSF1R P07333 2/20 0.62
LYN P07948 2/20 0.62
FLT1 P17948 2/20 0.62
NEK2 P51955 2/20 0.62

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
SCHEMBL6465409 1.00 LCK (0.74) LCKTEKSRCKDRFYN
SCHEMBL6460212 0.92 TEK (0.74) LCKTEKSRCKDRFYN
SCHEMBL7005371 0.90 TEK (0.61) LCKTEKSRCKDRFYN
SCHEMBL16752217 0.88 LCK (0.77) LCKTEKSRCKDRFYN
SCHEMBL6466185 0.88 TEK (0.62) LCKTEKSRCKDRFYN
SCHEMBL16752218 0.88 LCK (0.77) LCKTEKSRCKDRFYN
SCHEMBL6465581 0.88 TEK (0.62) LCKTEKSRCKDRFYN
SCHEMBL16752472 0.88 LCK (0.77) LCKTEKSRCKDRFYN
SCHEMBL6458946 0.88 TEK (0.76) LCKTEKSRCKDRFYN
SCHEMBL6883793 0.88 LCK (0.76) LCKTEKSRCKDRFYN

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 LCK 1/4885TEK 1465/4885SRC 46/4885
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents FLT1, FLT4, TFPI LCK 6/4885TEK 22/4885SRC 206/4885

“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.