SCHEMBL6715765

SCHEMBL6715765

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

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 10/20 0.39
PRKDC P78527 9/20 0.37
EGFR P00533 3/20 0.37
KIT P10721 1/20 0.36
ABL1 P00519 1/20 0.34
HCK P08631 1/20 0.34
SRC P12931 1/20 0.34
KDR P35968 1/20 0.34
PIK3CB P42338 1/20 0.34
MTOR P42345 1/20 0.34
PIK3CG P48736 1/20 0.34
EPHB4 P54760 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
PDE1B Q01064 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
SCHEMBL6719116 0.90 KCNH2 (0.37) KCNH2PRKDCEGFRKITABL1
SCHEMBL6718295 0.87 PRKDC (0.34) KCNH2PRKDC
SCHEMBL6719631 0.84 HSP90AB1 (0.38) KCNH2PRKDCEGFRKITABL1
SCHEMBL6719990 0.83 EGFR (0.39) PRKDCEGFRKITABL1HCK
SCHEMBL6718592 0.82 KDR (0.39) KCNH2PRKDCEGFRKITABL1
SCHEMBL6727273 0.82 EGFR (0.39) KCNH2PRKDCEGFRKITABL1
SCHEMBL6719303 0.82 PPOX (0.36) KCNH2
SCHEMBL6726970 0.82 PGK1 (0.36) EGFR
SCHEMBL6722700 0.80 KCNH2 (0.33) KCNH2PRKDCKITKDR
SCHEMBL6719105 0.80 KCNH2 (0.33) KCNH2PRKDCEGFRABL1HCK

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 KCNH2 371/4885PRKDC 2318/4885EGFR 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.