SCHEMBL600563

SCHEMBL600563

O=c1nc(-c2cc(C(F)(F)F)nc(C(F)(F)F)n2)[nH]o1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.34
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
KDM5B Q9UGL1 1/20 0.31

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
SCHEMBL603909 0.90 DRD3 (0.35)
SCHEMBL604061 0.84 SDHB (0.33) HPGDALDH1A1GAAKDM5B
SCHEMBL603661 0.80 MEN1 (0.36) HPGDALDH1A1
SCHEMBL601265 0.80 LMNA (0.50) HPGDALDH1A1
SCHEMBL601836 0.80 HSD17B10 (0.51) HPGDALDH1A1
SCHEMBL601205 0.80 CYP3A4 (0.33) HPGD
SCHEMBL602765 0.79 LCAT (0.36) HPGDALDH1A1
SCHEMBL18107 0.79 CA2 (0.39) HPGDKDM5B
SCHEMBL600564 0.75 KMO (0.36) HPGDALDH1A1GAAKDM5B
SCHEMBL2331490 0.73 F7 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2432780-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2012-03-28 EP disclosed
US-20120041009-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-16 US disclosed
WO-2010134478-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-25 WO 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-20120041009-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL TYMP, DPYD, TYMS HPGD 1037/4885ALDH1A1 2299/4885GAA 1427/4885

“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.