SCHEMBL7550243

SCHEMBL7550243

COC(=O)c1cccc2oc(COc3ccc(NC(C)=O)cc3)nc12

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
MAPT P10636 3/20 0.47
POLB P06746 2/20 0.47
GAA P10253 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
TOP2A P11388 2/20 0.44
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL7542460 0.92 SMN1; SMN2 (0.49) MEN1KMT2AMAPTPOLBGAA
SCHEMBL7543492 0.85 MAPT (0.45) KMT2AMAPTPOLBTOP2ACYP1A2
SCHEMBL7544427 0.83 MEN1 (0.51) MEN1KMT2AMAPTPOLBGAA
SCHEMBL7547340 0.80 MEN1 (0.60) MEN1KMT2AMAPTPOLBGAA
SCHEMBL7545447 0.79 MAPT (0.45) KMT2AMAPTPOLBTOP2ACYP1A2
SCHEMBL7544987 0.79 MAPT (0.56) MEN1KMT2AMAPTPOLBGAA
SCHEMBL7545090 0.79 MAPT (0.52) MEN1KMT2AMAPTPOLBGAA
SCHEMBL7549526 0.78 AGPAT2 (0.54) MEN1KMT2AMAPTPOLBGAA
SCHEMBL7721972 0.76 TOP2A (0.55) KMT2AMAPTPOLBGAATOP2A
SCHEMBL4307487 0.75 TOP2A (0.54) KMT2AMAPTPOLBGAAL3MBTL1

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