SCHEMBL7541413

SCHEMBL7541413

COC(=O)Nc1ccc(OCc2nc3ccccc3o2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
ALOX5 P09917 6/20 0.47
EPHX2 P34913 6/20 0.47
KDR P35968 1/20 0.47
PDE10A Q9Y233 1/20 0.46
ALOX5AP P20292 1/20 0.43
AGPAT2 O15120 1/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TP53 P04637 2/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 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
SCHEMBL7542425 0.90 ALOX5 (0.48) LMNAALOX5EPHX2KDRPDE10A
SCHEMBL7550333 0.89 MAPT (0.46) LMNAALOX5EPHX2KDRAGPAT2
SCHEMBL7541510 0.89 AGPAT2 (0.50) LMNAALOX5EPHX2KDRAGPAT2
SCHEMBL7542484 0.88 MAPT (0.52) LMNAPDE10AMEN1KMT2ANPC1
SCHEMBL7545865 0.88 AGPAT2 (0.49) LMNAALOX5EPHX2KDRPDE10A
SCHEMBL7541142 0.88 PDE10A (0.45) LMNAALOX5PDE10AALOX5APAGPAT2
SCHEMBL7547607 0.88 MAPT (0.46) LMNAALOX5EPHX2KDRAGPAT2
SCHEMBL7542077 0.87 CEPT1 (0.42) LMNAALOX5EPHX2KDRAGPAT2
SCHEMBL7545106 0.87 CEPT1 (0.42) LMNAALOX5EPHX2KDRAGPAT2
SCHEMBL27486934 0.87 PDE10A (0.44) LMNAALOX5PDE10AALOX5APAGPAT2

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 6 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 claimed
US-5736487-A HERBICIDES SANKYO COMPANY, LIMITED (JP) 1998-04-07 US claimed
EP-0795550-A1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-09-17 EP claimed
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