SCHEMBL604062

SCHEMBL604062

Cc1nc(-c2noc(=O)[nH]2)cc(C(F)(F)F)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KMO O15229 1/20 0.36
RARB P10826 1/20 0.35
TLR7 Q9NYK1 1/20 0.34
NR1I2 O75469 1/20 0.33
BRS3 P32247 1/20 0.33
PDE2A O00408 1/20 0.33
FABP4 P15090 2/20 0.33
SDHB P21912 2/20 0.33
DHODH Q02127 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
CNR1 P21554 1/20 0.32
USP30 Q70CQ3 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
SCHEMBL600564 0.84 KMO (0.36) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL603910 0.83 RARB (0.39) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL601837 0.82 HSD17B10 (0.50) HPGDALDH1A1KDM4EKMT2AHSD17B10
SCHEMBL603662 0.82 KMT2A (0.36) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL601206 0.82 THRA (0.35) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL601266 0.80 HPGD (0.51) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL602766 0.79 LCAT (0.35) HPGDKMOCNR1
SCHEMBL2338992 0.77 RARB (0.37) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL18108 0.77 KMO (0.52) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL604061 0.75 SDHB (0.33) HPGDALDH1A1KDM4EMEN1KMT2A

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 5 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
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 2299/4885KDM4E 1030/4885

“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.