SCHEMBL6646404

SCHEMBL6646404

COC(=O)/C(F)=C(\N)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
ALDH1A1 P00352 2/20 0.40
XBP1 P17861 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
F2 P00734 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
TET2 Q6N021 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HIF1A Q16665 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CES2 O00748 2/20 0.32
ACHE P22303 2/20 0.32
CES1 P23141 2/20 0.32
CYP1A2 P05177 1/20 0.31

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
SCHEMBL7617413 1.00 MAPT (0.40) MAPTALDH1A1XBP1MEN1KMT2A
SCHEMBL20043784 0.79 MAPT (0.47) MAPTALDH1A1XBP1MEN1KMT2A
SCHEMBL9653474 0.79 ALOX15 (0.43) MAPTALDH1A1LMNAHPGDNPSR1
SCHEMBL9653470 0.79 ALOX15 (0.43) MAPTALDH1A1LMNAHPGDNPSR1
SCHEMBL6734508 0.76 ALDH1A1 (0.37) MAPTALDH1A1MEN1KMT2AF2
SCHEMBL6734509 0.76 ALDH1A1 (0.37) MAPTALDH1A1MEN1KMT2AF2
SCHEMBL10923053 0.75 MAPT (0.42) MAPTALDH1A1XBP1MEN1KMT2A
SCHEMBL10923055 0.75 MAPT (0.42) MAPTALDH1A1XBP1MEN1KMT2A
SCHEMBL28564394 0.73 ALDH1A1 (0.47) MAPTALDH1A1TET2SMN1; SMN2NPSR1
SCHEMBL10642087 0.72 LDHA (0.35) ACHE

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
EP-1066267-B1 SUBSTITUTED PHENYL URACILS BAYER CROPSCIENCE AG (DE) 2004-05-12 EP disclosed
US-6448203-B1 CROP PROTECTION AGENTS, IN PARTICULAR AS HERBICIDES AND INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2002-09-10 US disclosed
US-6432879-B1 HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2002-08-13 US disclosed
EP-1066267-A1 SUBSTITUTED PHENYL URACILS Bayer Aktiengesellschaft (DE) 2001-01-10 EP disclosed
EP-0973765-A1 SUBSTITUTED ARYLURACILS BAYER AG (DE) 2000-01-26 EP disclosed
WO-1999052906-A1 SUBSTITUTED OXAZOLYLE AND THIAZOLYL URACIL HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-10-21 WO disclosed
WO-1999028302-A1 SUBSTITUTED PHENYL URACILS BAYER AKTIENGESELLSCHAFT (DE) 1999-06-10 WO disclosed
WO-1998046592-A1 SUBSTITUTED ARYLURACILS BAYER AKTIENGESELLSCHAFT (DE) 1998-10-22 WO disclosed
WO-1998040362-A1 SUBSTITUTED ARYLALKYLURACILS BAYER AKTIENGESELLSCHAFT (DE) 1998-09-17 WO disclosed