SCHEMBL7548792

SCHEMBL7548792

CCc1cc(OCc2nc3ccc(F)cc3s2)ccc1NC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.51
PDPK1 O15530 1/20 0.51
ALOX5 P09917 7/20 0.47
EPHX2 P34913 7/20 0.47
NPC1 O15118 4/20 0.46
KMT2A Q03164 3/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 3/20 0.45
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PTPN1 P18031 1/20 0.44
ALOX5AP P20292 1/20 0.43
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.43
CYP1A2 P05177 1/20 0.42

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
SCHEMBL7542041 0.92 DYRK1A (0.51) DYRK1AALOX5EPHX2NPC1KMT2A
SCHEMBL7551595 0.89 ALOX5 (0.51) DYRK1AALOX5EPHX2NPC1KMT2A
SCHEMBL7541047 0.89 ALOX5 (0.46) ALOX5EPHX2NPC1KMT2ARAB9A
SCHEMBL7545175 0.89 ALOX5 (0.60) DYRK1APDPK1ALOX5EPHX2NPC1
SCHEMBL7544900 0.89 NPC1 (0.56) DYRK1AALOX5EPHX2NPC1KMT2A
SCHEMBL7548803 0.88 ALOX5 (0.55) DYRK1APDPK1ALOX5EPHX2NPC1
SCHEMBL7541521 0.87 SMN1; SMN2 (0.50) DYRK1APDPK1ALOX5EPHX2NPC1
SCHEMBL7542457 0.87 ALOX5 (0.62) ALOX5EPHX2NPC1KMT2ARAB9A
SCHEMBL7546710 0.84 MAPT (0.57) DYRK1APDPK1ALOX5EPHX2NPC1
SCHEMBL7542633 0.83 ALOX5 (0.50) DYRK1AALOX5EPHX2NPC1KMT2A

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