SCHEMBL6727273

SCHEMBL6727273

COc1cc(-c2ncnc(C)c2Cl)c(F)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.39
HSP90AA1 P07900 4/20 0.38
HSP90AB1 P08238 4/20 0.38
KIT P10721 2/20 0.38
PRKDC P78527 3/20 0.35
KCNH2 Q12809 2/20 0.35
KDR P35968 3/20 0.34
EPHB4 P54760 2/20 0.34
ABL1 P00519 1/20 0.34
HCK P08631 1/20 0.34
SRC P12931 1/20 0.34
PIK3CB P42338 1/20 0.34
MTOR P42345 1/20 0.34
PIK3CG P48736 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
PPOX P50336 1/20 0.33
AURKA O14965 1/20 0.33
ERBB2 P04626 1/20 0.33
INSR P06213 1/20 0.33
FBP1 P09467 1/20 0.33

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
SCHEMBL6719990 0.87 EGFR (0.39) EGFRHSP90AA1HSP90AB1KITPRKDC
SCHEMBL6718592 0.86 KDR (0.39) EGFRHSP90AA1HSP90AB1KITPRKDC
SCHEMBL6718707 0.85 KMO (0.34) EGFRPRKDCPPOX
SCHEMBL6719116 0.82 KCNH2 (0.37) EGFRHSP90AA1HSP90AB1KITPRKDC
SCHEMBL6715765 0.82 KCNH2 (0.39) EGFRHSP90AA1HSP90AB1KITPRKDC
SCHEMBL6716002 0.82 EGFR (0.37) EGFRHSP90AA1HSP90AB1KITPRKDC
SCHEMBL6718220 0.79 PRKDC (0.34) EGFRHSP90AA1HSP90AB1PRKDCKCNH2
SCHEMBL6718722 0.79 EGFR (0.36) EGFRHSP90AA1HSP90AB1KITPRKDC
SCHEMBL27599023 0.77 PRKDC (0.41) PRKDCKCNH2
SCHEMBL7681163 0.77 HSP90AA1 (0.39) EGFRHSP90AA1HSP90AB1ABL1SRC

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 EGFR 3745/4885HSP90AA1 3014/4885HSP90AB1 3068/4885

“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.