SCHEMBL17844580

SCHEMBL17844580

O=C(O)c1ccc(-c2ccc(Cl)cc2)[nH]c1=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.72
ALDH1A1 P00352 3/20 0.65
GAA P10253 3/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
RXFP1 Q9HBX9 1/20 0.65
MAPK14 Q16539 1/20 0.49
GCGR P47871 1/20 0.44
TSHR P16473 3/20 0.43
CASP1 P29466 1/20 0.43
NR4A1 P22736 1/20 0.42
GRIK1 P39086 1/20 0.42
GRIA1 P42261 1/20 0.42
GRIA2 P42262 1/20 0.42
GRIA3 P42263 1/20 0.42
GRIA4 P48058 1/20 0.42
GRIK2 Q13002 1/20 0.42
GRIK3 Q13003 1/20 0.42
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL17844558 0.85 KDM4E (0.51) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL25149305 0.85 KDM4E (0.65) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL4429820 0.84 KDM4E (0.93) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL4074628 0.84 KDM4E (1.00) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL25149281 0.83 KDM4E (0.72) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL11111623 0.83 KDM4E (0.72) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL361765 0.83 KDM4E (0.72) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL11635055 0.79 KDM4E (0.72) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL25148574 0.79 KDM4E (0.61) KDM4EALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL25148762 0.79 KDM4E (0.66) KDM4EALDH1A1GAASMN1; SMN2RXFP1

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
WO-2016096942-A1 USE OF SELECTED PYRIDONE CARBOXAMIDES OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-06-23 WO disclosed