SCHEMBL11006012

SCHEMBL11006012

CCc1nc(OCC(=O)O)c(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
HTT P42858 2/20 0.47
PKM P14618 1/20 0.47
MCL1 Q07820 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2C19 P33261 1/20 0.39
GLA P06280 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
IAPP P10997 1/20 0.35
MAP3K8 P41279 1/20 0.35
PTPN7 P35236 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
SCHEMBL11000101 0.81 KDM4E (0.49) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL149659 0.80 TDP1 (0.45) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL29350609 0.80 TDP1 (0.45) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL37162 0.80 TDP1 (0.45) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL28421277 0.80 KDM4E (0.43) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL23633000 0.79 KDM4E (0.45) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL29157738 0.79 TDP1 (0.44) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL25394124 0.79 TDP1 (0.44) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL28924114 0.79 TDP1 (0.44) KDM4EHTTPKMMCL1TDP1
Triclopyr SCHEMBL29225326 0.79 TDP1 (0.44) KDM4EHTTPKMMCL1TDP1

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
US-4552586-A Certain 2-pyridyloxyacetanilides and their use as herbicides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1985-11-12 US disclosed
EP-0060423-B1 2-PYRIDYLOXYACETANILIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1984-04-11 EP disclosed