SCHEMBL1424317

SCHEMBL1424317

Cc1cc(N)c(Cl)c(C(=O)O)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.47
MAPK1 P28482 2/20 0.46
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP3A4 P08684 1/20 0.43
POLB P06746 2/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
GNG2 P59768 2/20 0.40
GNB1 P62873 2/20 0.40
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
ALOX15 P16050 1/20 0.40
BLM P54132 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
NR4A2 P43354 2/20 0.39
NCF1 P14598 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL29390992 0.81 TDP1 (0.50) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL3218994 0.81 TDP1 (0.50) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL116082 0.81 TDP1 (0.50) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL1424613 0.81 NQO2 (0.46) MAPK1ALDH1A1SMN1; SMN2POLBKMT2A
Potassium SCHEMBL30575490 0.79 TDP1 (0.48) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL1404403 0.79 TDP1 (0.48) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL28002634 0.79 TDP1 (0.48) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4
Butanedione SCHEMBL7585559 0.79 TDP1 (0.44) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4
Dimethylamine SCHEMBL17110604 0.79 TDP1 (0.44) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL2348206 0.78 TDP1 (0.47) TDP1MAPK1ALDH1A1SMN1; SMN2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608624-B1 6-ALKYL OR ALKENYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2011-03-23 EP disclosed
CN-100519532-C 6-alkyl-or alkenyl-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2009-07-29 CN disclosed
US-7432227-B2 6-alkyl or alkenyl-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-10-07 US disclosed
CN-1764646-A 6-alkyl-or alkenyl-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2006-04-26 CN disclosed
EP-1608624-A2 6-ALKYL OR ALKENYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 2005-12-28 EP disclosed
WO-2004089906-A2 6-ALKYL OR ALKENYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2004-10-21 WO disclosed
US-20040198608-A1 6-Alkyl or alkenyl-4-aminopicolinates and their use as herbicides CORTEVA AGRISCIENCE LLC 2004-10-07 US 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-20040198608-A1 6-Alkyl or alkenyl-4-aminopicolinates and their use as herbicides AADAC, AASDHPPT, AADAT TDP1 3420/4885MAPK1 4015/4885ALDH1A1 650/4885

“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.