SCHEMBL7543692

SCHEMBL7543692

COc1cccc2nc(COc3ccc(NC(C)=O)cc3)sc12

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
RAB9A P51151 3/20 0.54
ALDH1A1 P00352 2/20 0.54
NPC1 O15118 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
ALOX5 P09917 6/20 0.54
EPHX2 P34913 6/20 0.54
L3MBTL1 Q9Y468 1/20 0.49
TDP1 Q9NUW8 3/20 0.48
KDM4E B2RXH2 1/20 0.48
HPGD P15428 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL7543383 0.91 NPC1 (0.54) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7545465 0.88 MEN1 (0.55) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7548194 0.87 KMT2A (0.54) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7542414 0.87 EPHX2 (0.59) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7549360 0.83 DYRK1A (0.59) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7544458 0.81 NPC1 (0.79) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7543836 0.80 NPC1 (0.54) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7548826 0.79 EPHX2 (0.58) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7543782 0.79 NPC1 (0.53) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7550178 0.79 EPHX2 (0.54) MAPTMEN1KMT2ARAB9AALDH1A1

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