SCHEMBL29928384

SCHEMBL29928384

Nc1c(F)c(Cl)nc(C(=O)O)c1Cl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.69
LMNA P02545 3/20 0.36
GAA P10253 3/20 0.36
MAPT P10636 2/20 0.36
ATM Q13315 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
KMO O15229 2/20 0.33
NOX1 Q9Y5S8 1/20 0.33
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
GLA P06280 3/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 3/20 0.33
PLAU P00749 2/20 0.33
CYP1A2 P05177 2/20 0.33
SLC9A1 P19634 2/20 0.33
SLC22A1 O15245 1/20 0.33
HTR1A P08908 1/20 0.33

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
SCHEMBL1424187 1.00 TDP1 (0.69) TDP1LMNAGAAMAPTATM
SCHEMBL2342191 0.85 TDP1 (0.69) TDP1LMNAGAAMAPTATM
SCHEMBL19187069 0.83 TDP1 (0.56) TDP1KEAP1NFE2L2KDM4EHCAR2
Picloram SCHEMBL8467014 0.82 TDP1 (1.00) TDP1LMNAGAAMAPTATM
Picloram SCHEMBL29388079 0.82 TDP1 (1.00) TDP1LMNAGAAMAPTATM
Picloram SCHEMBL13299 0.82 TDP1 (1.00) TDP1LMNAGAAMAPTATM
SCHEMBL14354117 0.81 TDP1 (0.50) TDP1LMNAGAAKEAP1NFE2L2
SCHEMBL21806451 0.81 TDP1 (0.55) TDP1KEAP1NFE2L2KDM4EPLAU
SCHEMBL30151452 0.81 TDP1 (0.55) TDP1KEAP1NFE2L2KDM4EPLAU
SCHEMBL1424874 0.81 TDP1 (0.55) TDP1LMNAGAAMAPTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3458442-B1 SYNTHESIS OF 6-ARYL-4-AMINOPICOLINATES AND 2-ARYL-6-AMINOPYRIMIDINE-4-CARBOXYLATES BY DIRECT SUZUKI COUPLING CORTEVA AGRISCIENCE LLC (US) 2022-12-28 EP claimed
CN-115298167-A Improved synthesis of 6-aryl-4-aminopicolinates 科迪华农业科技有限责任公司 2022-11-04 CN disclosed