SCHEMBL4471036

SCHEMBL4471036

COc1cc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)ccc1-c1csc2ncnc(N)c12

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 10/20 0.75
FLT3 P36888 8/20 0.75
FLT1 P17948 7/20 0.75
CSF1R P07333 5/20 0.75
LCK P06239 4/20 0.75
FGFR1 P11362 4/20 0.75
FGFR3 P22607 4/20 0.75
GSK3B P49841 4/20 0.75
AURKA O14965 4/20 0.75
PLK4 O00444 3/20 0.75
PDPK1 O15530 3/20 0.75
CHEK2 O96017 3/20 0.75
ABL1 P00519 3/20 0.75
NTRK1 P04629 3/20 0.75
FYN P06241 3/20 0.75
LYN P07948 3/20 0.75
RPS6KB1 P23443 3/20 0.75
MARK3 P27448 3/20 0.75
EPHA2 P29317 3/20 0.75
CSNK1D P48730 3/20 0.75

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
SCHEMBL4486498 0.90 KIT (0.82) KITFLT3FLT1CSF1RLCK
SCHEMBL4487735 0.90 KIT (0.82) KITFLT3FLT1CSF1RLCK
SCHEMBL4467337 0.88 KDR (0.78) KITFLT3FLT1CSF1RLCK
SCHEMBL4481150 0.88 KIT (0.69) KITFLT3FLT1CSF1RLCK
SCHEMBL4478281 0.88 KIT (0.78) KITFLT3FLT1CSF1RLCK
SCHEMBL4473182 0.86 KIT (0.76) KITFLT3FLT1CSF1RLCK
SCHEMBL546436 0.86 KIT (1.00) KITFLT3FLT1CSF1RLCK
SCHEMBL30055372 0.86 KIT (1.00) KITFLT3FLT1CSF1RLCK
Hydrochloric Acid SCHEMBL4301600 0.85 KIT (0.98) KITFLT3FLT1CSF1RLCK
Bromide SCHEMBL5436521 0.85 KIT (0.98) KITFLT3FLT1CSF1RLCK

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 KIT 394/4885FLT3 29/4885FLT1 337/4885
US-20060276490-A1 Thiopyrimidine and isothiazolopyrimidine Kinase Inhibitors ABL1, LCK, ERBB2 KIT 361/4885FLT3 16/4885FLT1 459/4885
US-20030225273-A1 Thiopyrimidine and isothiazolopyrimidine kinase inhibitors ABL1, ERBB2, LCK KIT 394/4885FLT3 29/4885FLT1 337/4885

“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.