SCHEMBL600564

SCHEMBL600564

O=c1[nH]c(-c2cc(C(F)(F)F)nc(C(F)(F)F)n2)no1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.36
HPGD P15428 2/20 0.36
ALDH1A1 P00352 4/20 0.33
RARB P10826 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CNR1 P21554 1/20 0.32
ALOX5 P09917 1/20 0.32
NR1I2 O75469 1/20 0.32
BRS3 P32247 1/20 0.32
POLB P06746 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
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
SCHEMBL603910 0.90 RARB (0.39) KMOHPGDALDH1A1RARBKDM4E
SCHEMBL604062 0.84 HPGD (0.37) KMOHPGDALDH1A1RARBKDM4E
SCHEMBL601837 0.81 HSD17B10 (0.50) KMOHPGDALDH1A1KDM4EKMT2A
SCHEMBL601266 0.81 HPGD (0.51) KMOHPGDALDH1A1KDM4EMEN1
SCHEMBL603662 0.81 KMT2A (0.36) KMOHPGDALDH1A1RARBKDM4E
SCHEMBL601206 0.81 THRA (0.35) KMOHPGDALDH1A1RARBKDM4E
SCHEMBL602766 0.80 LCAT (0.35) KMOHPGDCNR1
SCHEMBL18108 0.78 KMO (0.52) KMOHPGDALDH1A1RARBKDM4E
SCHEMBL17877 0.77 KMO (0.39) KMOALDH1A1RARBKMT2AALOX5
SCHEMBL600563 0.75 HPGD (0.34) HPGDALDH1A1GAAKDM5B

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 4 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
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 KMO 868/4885HPGD 1037/4885ALDH1A1 2299/4885

“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.