SCHEMBL3454271

SCHEMBL3454271

CC(C)OC(=O)C(Oc1ccc(Cl)c2cccnc12)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.55
ALOX12 P18054 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
CYP3A4 P08684 1/20 0.55
GAA P10253 2/20 0.52
PKM P14618 1/20 0.50
NPSR1 Q6W5P4 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 1/20 0.47
MAPT P10636 6/20 0.47
L3MBTL1 Q9Y468 5/20 0.46
HSP90AA1 P07900 3/20 0.46
CCR6 P51684 2/20 0.46
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HSD17B10 Q99714 2/20 0.46
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL30112294 1.00 KDM4E (0.55) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL168947 0.88 KDM4E (0.62) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL31606573 0.86 KDM4E (0.55) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL9245905 0.86 KDM4E (0.57) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL571602 0.83 KDM4E (0.63) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL167490 0.80 KDM4E (0.59) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL30050527 0.80 KDM4E (0.59) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL13625112 0.79 KDM4E (0.60) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL27466936 0.78 KDM4E (0.67) KDM4EALOX12TDP1CYP3A4GAA
SCHEMBL9282530 0.78 KDM4E (0.59) KDM4EALOX12TDP1CYP3A4GAA

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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023202364-A1 HERBICIDAL COMPOSITION COMPRISING PYRIMIDINE FORMYL OXIME DERIVATIVE AND USE THEREOF 青岛清原作物科学有限公司 2023-10-26 WO disclosed
WO-2023197899-A1 HERBICIDAL COMPOSITION CONTAINING FUSED RING-SUBSTITUTED AROMATIC COMPOUND AND USE THEREOF 青岛清原作物科学有限公司 2023-10-19 WO disclosed
CN-112741096-B Herbicidal compositions comprising N- (1, 3, 4-oxadiazol-2-yl) arylcarboxamides and their use 江苏清原农冠杂草防治有限公司 2023-01-31 CN disclosed
CN-109526973-B Ternary weeding composition containing xaflufen-ethyl and application thereof 青岛清原化合物有限公司 2023-01-24 CN disclosed
CN-109418274-B Ternary weeding composition and application thereof 青岛清原化合物有限公司 2022-12-06 CN disclosed
CN-112741097-B Herbicidal compositions comprising N- (1, 3, 4-oxadiazol-2-yl) arylcarboxamides and their use 江苏清原农冠杂草防治有限公司 2022-11-29 CN disclosed
CN-114431236-A Ternary herbicidal compositions comprising carboxylic acid derivative-substituted oxyiminoaryl compounds and their use 青岛清原化合物有限公司 2022-05-06 CN disclosed
CN-114431244-A Ternary herbicidal composition containing HPPD inhibitor herbicide and application thereof 青岛清原化合物有限公司 2022-05-06 CN disclosed
CN-113142217-B Ternary herbicidal composition containing HPPD inhibitor herbicide and application thereof 青岛清原化合物有限公司 2022-04-22 CN disclosed
CN-114304165-A Binary weeding composition and application thereof 青岛清原化合物有限公司 2022-04-12 CN disclosed
CN-1725951-A Microemulsion concentrates BAYER CROPSCIENCE GMBH (DE) 2006-01-25 CN disclosed
CN-1646015-A Herbicide combinations comprising special sulphonyl ureas BAYER CROPSCIENCE GMBH (DE) 2005-07-27 CN disclosed
CN-1642429-A Herbicidal compositions comprising specific sulfonylureas BAYER CROPSCIENCE GMBH (DE) 2005-07-20 CN disclosed
CN-1642427-A Herbicide combination with acylated aminophenylsulfonylureas BAYER CROPSCIENCE GMBH (DE) 2005-07-20 CN disclosed
CN-1642426-A Herbicidal compositions comprising specific sulfonylureas BAYER CROPSCIENCE GMBH (DE) 2005-07-20 CN disclosed
CN-1167340-C Combinations of herbicides and safeners �Ϻ���ͨ��ѧ 2004-09-22 CN disclosed
CN-1318978-A Herbicidal compositions containing substituted phenoxysulfonylureas AVENTIS CROPSCIENCE GMBH (DE) 2001-10-24 CN disclosed
CN-1314785-A Herbicidal compositions containing substituted phenylsulfonylureas for controlling paddy-field weeds HOECHST SCHERING AGREVO GMBH (DE) 2001-09-26 CN disclosed
CN-1306395-A Combinations of herbicides and safeners AVENTIS CROPSCIENCE GMBH (DE) 2001-08-01 CN disclosed
CN-1239867-A Herbicidal compositions comprising N- [ (4, 6-dimethoxypyrimidin-2-yl) aminocarbonyl ] -5-methylsulphinylaminomethyl-2-alkoxycarbonylbenzenesulfonamide HOECHST SCHERING AGREVO GMBH (DE) 1999-12-29 CN disclosed