SCHEMBL6360307

SCHEMBL6360307

Cc1c(Cl)cccc1Oc1ncnc(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EGFR P00533 3/20 0.40
HSD11B1 P28845 7/20 0.39
NR1I2 O75469 3/20 0.39
TRPA1 O75762 3/20 0.38
MRGPRX1 Q96LB2 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
EPAS1 Q99814 1/20 0.38
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
SCN9A Q15858 1/20 0.36
HSD11B2 P80365 1/20 0.36

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
SCHEMBL3370619 0.88 MEN1 (0.41) MEN1KMT2AEGFRHSD11B1NR1I2
SCHEMBL5196093 0.86 KMT2A (0.50) MEN1KMT2AEGFRTRPA1MRGPRX1
SCHEMBL3488162 0.84 MRGPRX1 (0.44) MEN1KMT2AEGFRTRPA1MRGPRX1
SCHEMBL30377367 0.78 SCN9A (0.40) MEN1KMT2AEGFRHSD11B1NR1I2
SCHEMBL16378820 0.75 KMT2A (0.56) MEN1KMT2AEGFRTRPA1MRGPRX1
SCHEMBL2140667 0.75 HSD11B1 (0.43) HSD11B1NR1I2EPAS1HSD11B2
SCHEMBL1456975 0.73 KMT2A (0.50) MEN1KMT2AEGFRTRPA1MRGPRX1
SCHEMBL30374325 0.73 KMT2A (0.50) MEN1KMT2AEGFRTRPA1MRGPRX1
SCHEMBL14430205 0.73 SCN9A (0.38) MEN1KMT2AEGFRCYP1A2CYP2C19
SCHEMBL13970688 0.72 EPAS1 (0.49) HSD11B1NR1I2EPAS1ALDH1A1HSD11B2

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
US-20050124498-A1 Halobenzyl substituted phenylaceto esters and amides and use thereof for prevention of harmful organisms BAYER CROPSCIENCE AG (DE) 2005-06-09 US disclosed
EP-1185505-B1 METHOD OF PRODUCING METHOXYIMINO ACETIC AMIDE BAYER CROPSCIENCE AG (DE) 2004-11-03 EP disclosed
US-6660872-B1 In high yields BAYER AKTIENGESELLSCHAFT (DE) 2003-12-09 US disclosed
EP-1185505-A1 METHOD OF PRODUCING METHOXYIMINO ACETIC AMIDE Bayer Aktiengesellschaft (DE) 2002-03-13 EP disclosed
WO-2000071504-A1 METHOD OF PRODUCING METHOXYIMINO ACETIC AMIDE BAYER AKTIENGESELLSCHAFT (DE) 2000-11-30 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-20050124498-A1 Halobenzyl substituted phenylaceto esters and amides and use thereof for prevention of harmful organisms HDHD5, GNPAT, PGLS MEN1 4472/4885KMT2A 1592/4885EGFR 2602/4885

“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.