SCHEMBL7542768

SCHEMBL7542768

COc1ccc2nc(COc3ccc(NC(C)=O)cc3)sc2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.64
KDM4E B2RXH2 5/20 0.64
MEN1 O00255 5/20 0.64
KMT2A Q03164 5/20 0.64
TDP1 Q9NUW8 4/20 0.64
HPGD P15428 4/20 0.64
ALDH1A1 P00352 4/20 0.64
GAA P10253 3/20 0.64
HTT P42858 2/20 0.64
NPC1 O15118 3/20 0.61
RAB9A P51151 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C19 P33261 1/20 0.61
DYRK1A Q13627 1/20 0.61
LMNA P02545 3/20 0.60
RECQL P46063 3/20 0.60
POLB P06746 2/20 0.60
MAPK1 P28482 2/20 0.60

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
SCHEMBL7548568 0.91 NPC1 (0.61) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7545050 0.91 MAPT (0.58) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7544842 0.90 MAPT (0.68) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7548640 0.88 EPHX2 (0.65) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7546658 0.88 MAPT (0.57) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7546710 0.88 MAPT (0.57) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7543795 0.85 ALOX5 (0.61) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7544458 0.85 NPC1 (0.79) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7541248 0.84 MAPT (0.55) MAPTKDM4EMEN1KMT2ATDP1
SCHEMBL7541718 0.84 SMN1; SMN2 (0.56) MAPTKDM4EMEN1KMT2ATDP1

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