SCHEMBL710689

SCHEMBL710689

O=C1c2ccccc2C(=O)N1O.O=C1c2ccccc2C(=O)N1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 2/20 0.62
FEN1 P39748 2/20 0.62
ERCC4 Q92889 2/20 0.62
RNASEH1 O60930 1/20 0.56
POLB P06746 3/20 0.50
MAPT P10636 2/20 0.50
CYP1A2 P05177 2/20 0.50
TSHR P16473 1/20 0.50
ALOX12 P18054 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
CASP3 P42574 1/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
PABPC1 P11940 1/20 0.46
XBP1 P17861 1/20 0.46
NFKB1 P19838 1/20 0.46

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
SCHEMBL29361703 1.00 ERCC1 (0.62) ERCC1FEN1ERCC4RNASEH1POLB
SCHEMBL1410 1.00 ERCC1 (0.62) ERCC1FEN1ERCC4RNASEH1POLB
Potassium SCHEMBL30855375 0.97 ERCC1 (0.60) ERCC1FEN1ERCC4RNASEH1POLB
SCHEMBL1279494 0.97 ERCC1 (0.60) ERCC1FEN1ERCC4RNASEH1POLB
Charcoal, Activated SCHEMBL29534893 0.97 ERCC1 (0.60) ERCC1FEN1ERCC4RNASEH1POLB
Water SCHEMBL4444794 0.97 ERCC1 (0.60) ERCC1FEN1ERCC4RNASEH1POLB
Methane SCHEMBL28815225 0.97 ERCC1 (0.60) ERCC1FEN1ERCC4RNASEH1POLB
Ammonia Solution, Strong SCHEMBL8656352 0.97 ERCC1 (0.60) ERCC1FEN1ERCC4RNASEH1POLB
SCHEMBL2824834 0.97 ERCC1 (0.60) ERCC1FEN1ERCC4RNASEH1POLB
SCHEMBL2824836 0.97 ERCC1 (0.60) ERCC1FEN1ERCC4RNASEH1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421832-A1 N-ALKOXYAMIDES OF 6-(SUBSTITUTED PHENYL)-4-AMINOPICOLINATES AND 2-(SUBSTITUTED PHENYL)-6-AMINO-4-PYRIMIDINECARBOXYLATES AND THEIR USE AS SELECTIVE HERBICIDES FOR CROPS Dow AgroSciences LLC (US) 2012-02-29 EP disclosed