SCHEMBL3370619

SCHEMBL3370619

Cc1c(Cl)cccc1Oc1ncnc(Cl)c1F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EGFR P00533 2/20 0.40
MRGPRX1 Q96LB2 4/20 0.38
TRPA1 O75762 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
EPAS1 Q99814 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
SCN9A Q15858 2/20 0.36
HSD11B1 P28845 4/20 0.36
NR1I2 O75469 2/20 0.36
MRGPRX4 Q96LA9 1/20 0.35

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
SCHEMBL6360307 0.88 MEN1 (0.41) MEN1KMT2AEGFRMRGPRX1TRPA1
SCHEMBL30374325 0.86 KMT2A (0.50) MEN1KMT2AEGFRMRGPRX1TRPA1
SCHEMBL1456975 0.86 KMT2A (0.50) MEN1KMT2AEGFRMRGPRX1TRPA1
SCHEMBL3488162 0.84 MRGPRX1 (0.44) MEN1KMT2AEGFRMRGPRX1TRPA1
SCHEMBL30377367 0.78 SCN9A (0.40) MEN1KMT2AEGFRMRGPRX1TRPA1
SCHEMBL16378820 0.75 KMT2A (0.56) MEN1KMT2AEGFRMRGPRX1TRPA1
SCHEMBL24540615 0.74 PIN1 (0.46) EGFRMRGPRX1GPR119
SCHEMBL5196093 0.73 KMT2A (0.50) MEN1KMT2AEGFRMRGPRX1TRPA1
SCHEMBL14430205 0.73 SCN9A (0.38) MEN1KMT2AEGFRCYP1A2CYP2C19
SCHEMBL1456728 0.72 TRPA1 (0.45) MEN1KMT2AEGFRMRGPRX1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268446-B1 METHOD FOR PRODUCING ASYMMETRICAL 4,6-BIS(ARYLOXY)PYRIMIDINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-10-06 EP disclosed
EP-1268446-B1 METHOD FOR PRODUCING ASYMMETRICAL 4,6-BIS(ARYLOXY)PYRIMIDINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-10-06 EP disclosed
US-6734304-B2 REACTING THE CORRESPONDING 4.6-DIHALOPYRIMIDINE COMPOUND WITH BASE; ONE POT PROCESS BAYER AKTIENGESELLSCHAFT (DE) 2004-05-11 US disclosed
US-20030092723-A1 Method for producing asymmetrical 4,6-bis(aryloxy)pyrimidine derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-05-15 US disclosed
EP-1268446-A1 METHOD FOR PRODUCING ASYMMETRICAL 4,6-BIS(ARYLOXY)PYRIMIDINE DERIVATIVES Bayer CropScience AG (DE) 2003-01-02 EP disclosed
WO-2001072719-A1 METHOD FOR PRODUCING ASYMMETRICAL 4,6-BIS(ARYLOXY)PYRIMIDINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2001-10-04 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-20030092723-A1 Method for producing asymmetrical 4,6-bis(aryloxy)pyrimidine derivatives DPYD, TYMS, TYMP MEN1 4310/4885KMT2A 2163/4885EGFR 1743/4885

“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.