SCHEMBL7598957

SCHEMBL7598957

CCOC(=O)C=C(N)CC(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.46
ALOX15 P16050 1/20 0.40
HCAR2 Q8TDS4 1/20 0.38
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL5454457 0.83 NPSR1 (0.47) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL5454460 0.83 NPSR1 (0.47) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL4297724 0.79 NPSR1 (0.47) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL4297722 0.79 NPSR1 (0.47) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL7913300 0.79 NPSR1 (0.50) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL7424929 0.79 NPSR1 (0.50) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL7424926 0.79 NPSR1 (0.50) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL4753860 0.78 NPSR1 (0.54) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL3190948 0.78 NPSR1 (0.54) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL7912959 0.78 NPSR1 (0.54) NPSR1ALOX15HCAR2ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5919732-A Herbicidal 3-arylamino-6-trifluoromethyluracils HOECHST SCHERING AGREVO GMBH (DE) 1999-07-06 US claimed
EP-0858997-B1 Fungicides SYNGENTA LTD (GB) 2002-12-18 EP disclosed
CN-1325624-A Herbicides of benzoyloxy unsaturated carboxylate type SHENHANG CHEMICAL INST (CN) 2001-12-12 CN disclosed
US-5919732-A Herbicidal 3-arylamino-6-trifluoromethyluracils HOECHST SCHERING AGREVO GMBH (DE) 1999-07-06 US disclosed
US-5830890-A NITROGEN HETEROCYCLE ATTACHED THROUGH OXYMETHYLENE GROUP TO PHENYL RING WITH O-METHYL 3-METHOXYACRYLATE OR WITH METHYL 3-METHOXYIMINOACETATE OR AMIDE DERIVATIVE ZENECA LIMITED (GB) 1998-11-03 US disclosed
EP-0858997-A1 Fungicides ZENECA LIMITED (GB) 1998-08-19 EP disclosed
EP-0769495-A1 Fungicides ZENECA LIMITED (GB) 1997-04-23 EP disclosed
WO-1995017096-A1 HERBICIDAL HALOALKYLURACILS FMC CORPORATION (US) 1995-06-29 WO disclosed
US-5399543-A Chemical intermediates for the herbicides also claimed. FMC CORPORATION (US) 1995-03-21 US disclosed