SCHEMBL7543974

SCHEMBL7543974

COCCC(=O)Nc1ccc(OCc2nc3ccccc3s2)cc1

nearest known ligand 0.77

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.77
RAB9A P51151 5/20 0.77
MAPT P10636 4/20 0.77
SMN1; SMN2 Q16637 4/20 0.77
KMT2A Q03164 4/20 0.77
ALDH1A1 P00352 3/20 0.77
MEN1 O00255 3/20 0.77
KDM4E B2RXH2 1/20 0.74
TDP1 Q9NUW8 1/20 0.74
ALOX5 P09917 9/20 0.69
EPHX2 P34913 9/20 0.69
POLB P06746 2/20 0.55
MAPK1 P28482 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
LMNA P02545 1/20 0.55
PKM P14618 1/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52

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
SCHEMBL7541535 0.89 ALDH1A1 (0.80) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL7542600 0.87 NPC1 (1.00) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL7548380 0.86 MAPT (0.82) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL7544973 0.85 NPC1 (0.77) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL7548466 0.85 MAPT (0.81) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL7543398 0.85 ALOX5 (0.70) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL7540872 0.84 NPC1 (0.79) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL7544458 0.84 NPC1 (0.79) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL8769691 0.83 EPHX2 (0.84) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL7541729 0.83 ALDH1A1 (0.80) NPC1RAB9AMAPTSMN1; SMN2KMT2A

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