SCHEMBL4488134

SCHEMBL4488134

Nc1ccc(-c2csc3ncnc(N)c23)cn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.66
LCK P06239 6/20 0.66
RET P07949 6/20 0.66
FGFR1 P11362 6/20 0.66
FLT1 P17948 6/20 0.66
MAP4K4 O95819 5/20 0.66
ABL1 P00519 5/20 0.66
NTRK1 P04629 5/20 0.66
CSF1R P07333 5/20 0.66
CLK2 P49760 5/20 0.66
RPS6KA3 P51812 5/20 0.66
MAP4K2 Q12851 5/20 0.66
ROCK1 Q13464 5/20 0.66
DYRK1A Q13627 5/20 0.66
NTRK2 Q16620 5/20 0.66
TAOK1 Q7L7X3 5/20 0.66
CLK4 Q9HAZ1 5/20 0.66
GSK3B P49841 4/20 0.66
MET P08581 4/20 0.66
NTRK3 Q16288 4/20 0.66

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
SCHEMBL4482587 0.85 KDR (0.62) KDRLCKRETFGFR1FLT1
SCHEMBL4486113 0.83 KDR (0.77) KDRLCKRETFGFR1FLT1
SCHEMBL14013968 0.80 FGFR1 (1.00) KDRLCKRETFGFR1FLT1
SCHEMBL4465814 0.75 KDR (0.61) KDRLCKRETFGFR1FLT1
SCHEMBL31165898 0.75 KDR (0.61) KDRLCKRETFGFR1FLT1
SCHEMBL31165908 0.75 KDR (0.61) KDRLCKRETFGFR1FLT1
SCHEMBL4477124 0.75 KDR (0.61) KDRLCKRETFGFR1FLT1
SCHEMBL4473831 0.74 KDR (0.63) KDRLCKRETFGFR1FLT1
SCHEMBL14414209 0.74 MAP4K4 (0.63) KDRLCKRETFGFR1FLT1
SCHEMBL4481360 0.72 KDR (0.69) KDRLCKRETFGFR1FLT1

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
EP-1487841-B1 THIOPYRIMIDINE AND ISOTHIAZOLOPYRIMIDINE KINASE INHIBITORS ABBVIE INC (US) 2014-01-15 EP disclosed
US-7560552-B2 Thiopyrimidine and isothiazolopyrimidine kinase inhibitors ABBOTT LABORATORIES (US) 2009-07-14 US disclosed
US-20060276490-A1 Thiopyrimidine and isothiazolopyrimidine Kinase Inhibitors MICHAELIDES MICHAEL R 2006-12-07 US disclosed
US-20040014756-A1 Thiopyrimidine and isothiazolopyrimidine kinase inhibitors ABBVIE INC. 2004-01-22 US disclosed
US-20030225273-A1 Thiopyrimidine and isothiazolopyrimidine kinase inhibitors ABBOTT LABORATORIES 2003-12-04 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 (3 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-20040014756-A1 Thiopyrimidine and isothiazolopyrimidine kinase inhibitors ABL1, ERBB2, LCK KDR 425/4885LCK 3/4885RET 72/4885
US-20060276490-A1 Thiopyrimidine and isothiazolopyrimidine Kinase Inhibitors ABL1, LCK, ERBB2 KDR 391/4885LCK 2/4885RET 42/4885
US-20030225273-A1 Thiopyrimidine and isothiazolopyrimidine kinase inhibitors ABL1, ERBB2, LCK KDR 425/4885LCK 3/4885RET 72/4885

“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.