SCHEMBL6715840

SCHEMBL6715840

Cc1c(-c2cc(N)c(C#N)cc2F)ncnc1C(F)F

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.34
ABL1 P00519 3/20 0.34
EGFR P00533 3/20 0.34
HCK P08631 3/20 0.34
SRC P12931 3/20 0.34
KDR P35968 3/20 0.34
PIK3CA P42336 3/20 0.34
PIK3CB P42338 3/20 0.34
MTOR P42345 3/20 0.34
PIK3CG P48736 3/20 0.34
EPHB4 P54760 3/20 0.34
PRKDC P78527 3/20 0.34
EGLN2 Q96KS0 3/20 0.33
KHK P50053 1/20 0.32
HSP90AB1 P08238 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
PI4KB Q9UBF8 1/20 0.30

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
SCHEMBL6719294 0.85 KHK (0.38) PIK3CDABL1EGFRHCKSRC
SCHEMBL6716143 0.80 GRIA1 (0.37)
SCHEMBL6727241 0.80 KHK (0.38) PIK3CDABL1EGFRHCKSRC
SCHEMBL6719653 0.80 KIT (0.34) PIK3CDABL1EGFRHCKSRC
SCHEMBL6727091 0.77 KHK (0.39) PIK3CDABL1EGFRHCKSRC
SCHEMBL6719980 0.77 PGR (0.38) ALOX5APFEN1
SCHEMBL6719687 0.72 KIT (0.34) ABL1EGFRHCKSRCKDR
SCHEMBL6722926 0.72 KHK (0.37) ABL1EGFRHCKSRCKDR
SCHEMBL6719991 0.72 KIT (0.41)
SCHEMBL6719174 0.70 KHK (0.38) KHKALOX5APFEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092402-A1 Pyrimidine derivatives and herbicides containing the same SUMITOMO CHEMICAL TAKEDA AGRO COMPANY, LIMITED (JP) 2004-05-13 US disclosed
EP-1333029-A1 PYRIMIDINE DERIVATIVES AND HERBICIDES CONTAINING THE SAME Sumitomo Chemical Takeda Agro Company, Limited (JP) 2003-08-06 EP 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 (1 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-20040092402-A1 Pyrimidine derivatives and herbicides containing the same DDX41, CBR3, DPYD PIK3CD 2114/4885ABL1 867/4885EGFR 3745/4885

“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.