SCHEMBL3842035

SCHEMBL3842035

CC(=O)Nc1cc(-c2ccc(Cl)c(C(F)F)c2Cl)nc(C(=O)O)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 3/20 0.38
NUDT1 P36639 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 3/20 0.34
SCN9A Q15858 1/20 0.34
SCN2A Q99250 1/20 0.34
SCN3A Q9NY46 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
ABL1 P00519 3/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 0.33
HPGD P15428 2/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 1/20 0.33
SLC6A3 Q01959 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL3841605 0.92 KDM4E (0.37) KDM4EHSD17B10NUDT1KMT2AMEN1
SCHEMBL3330604 0.89 ALDH1A1 (0.43) KDM4ENUDT1KMT2AMEN1ALDH1A1
SCHEMBL3839254 0.87 KDM4E (0.36) KDM4EHSD17B10NUDT1KMT2AMEN1
SCHEMBL17797224 0.85 NUDT1 (0.36) KDM4EHSD17B10NUDT1KMT2AMEN1
SCHEMBL3842958 0.84 MEN1 (0.38) KDM4EHSD17B10NUDT1KMT2AMEN1
SCHEMBL2470012 0.83 ALDH1A1 (0.38) KDM4EHSD17B10NUDT1KMT2AMEN1
SCHEMBL3840085 0.83 KDM4E (0.36) KDM4EHSD17B10NUDT1KMT2AMEN1
SCHEMBL3842956 0.83 ADORA3 (0.36) KDM4EHSD17B10NUDT1ALDH1A1SCN9A
SCHEMBL3836852 0.82 ALDH1A1 (0.42) KDM4ENUDT1KMT2AMEN1ALDH1A1
SCHEMBL28792444 0.81 RIPK1 (0.35) KDM4EHSD17B10NUDT1ALDH1A1SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2060566-B1 Poly-substituted aryls DOW AGROSCIENCES LLC (US) 2016-06-08 EP claimed
EP-2060566-B1 Poly-substituted aryls DOW AGROSCIENCES LLC (US) 2016-06-08 EP disclosed
EP-1973881-B1 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2009-10-28 EP disclosed
EP-2060566-A1 Poly-substituted aryls Dow AgroSciences LLC (US) 2009-05-20 EP disclosed
US-7498468-B2 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2009-03-03 US disclosed
EP-1973881-A2 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES Dow Agrosciences LLC (US) 2008-10-01 EP disclosed
US-20080051596-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-02-28 US disclosed
US-20080045734-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-02-21 US disclosed
US-7314849-B2 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-01-01 US disclosed
US-20070179060-A1 6-(Poly-substituted aryl)-4-aminopicolinates and their use as herbicides CORTEVA AGRISCIENCE LLC 2007-08-02 US disclosed
WO-2007082098-A2 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2007-07-19 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 (3 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-20080045734-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC KDM4E 672/4885HSD17B10 2174/4885NUDT1 3881/4885
US-20070179060-A1 6-(Poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC KDM4E 672/4885HSD17B10 2174/4885NUDT1 3881/4885
US-20080051596-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC KDM4E 672/4885HSD17B10 2174/4885NUDT1 3881/4885

“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.