SCHEMBL7550271

SCHEMBL7550271

CC(=O)Nc1ccc(OCc2nc3cc(C)ccc3s2)c(C)c1C

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.52
EPHX2 P34913 10/20 0.46
ALOX5 P09917 9/20 0.46
NPC1 O15118 3/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 2/20 0.40
PTPRE P23469 1/20 0.39

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
SCHEMBL7544292 0.92 DYRK1A (0.52) DYRK1AEPHX2ALOX5NPC1GAA
SCHEMBL7550288 0.90 EPHX2 (0.52) DYRK1AEPHX2ALOX5LMNA
SCHEMBL7544351 0.90 DYRK1A (0.52) DYRK1AEPHX2ALOX5NPC1RAB9A
SCHEMBL7548621 0.89 DYRK1A (0.55) DYRK1AEPHX2ALOX5NPC1MAPT
SCHEMBL7541020 0.87 DYRK1A (0.54) DYRK1AEPHX2ALOX5
SCHEMBL7550313 0.87 NPC1 (0.58) EPHX2ALOX5NPC1MEN1LMNA
SCHEMBL7549484 0.86 EPHX2 (0.43) DYRK1AEPHX2ALOX5NPC1MEN1
SCHEMBL7541645 0.83 DYRK1A (0.52) DYRK1AEPHX2ALOX5NPC1GAA
SCHEMBL7548333 0.83 ALOX5 (0.62) DYRK1AEPHX2ALOX5NPC1MEN1
SCHEMBL7541627 0.82 NPC1 (0.55) DYRK1AEPHX2ALOX5NPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795550-B1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO CO (JP) 2002-06-05 EP disclosed
US-5736487-A HERBICIDES SANKYO COMPANY, LIMITED (JP) 1998-04-07 US disclosed
EP-0795550-A1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-09-17 EP disclosed