SCHEMBL7544004

SCHEMBL7544004

CC(=O)Nc1ccc(OCc2nc3ccc(C)cc3o2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
KDM4E B2RXH2 1/20 0.46
TP53 P04637 4/20 0.45
THRB P10828 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
POLB P06746 2/20 0.45
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALOX5 P09917 2/20 0.41
EPHX2 P34913 2/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
CETP P11597 1/20 0.40
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
USP2 O75604 1/20 0.40
MAPK10 P53779 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
SCHEMBL7550333 0.92 MAPT (0.46) MAPTKDM4ETP53THRBSMN1; SMN2
SCHEMBL7542942 0.92 AGPAT2 (0.43) MAPTKDM4ETP53THRBSMN1; SMN2
SCHEMBL7541499 0.90 DRD2 (0.47) MAPTTP53POLBLMNAALOX5
SCHEMBL7542425 0.88 ALOX5 (0.48) MAPTTP53POLBMEN1KMT2A
SCHEMBL7541433 0.88 MAPT (0.46) MAPTKDM4ETP53SMN1; SMN2POLB
SCHEMBL7548836 0.84 MAPT (0.46) MAPTKDM4ETP53THRBSMN1; SMN2
SCHEMBL7541140 0.83 LMNA (0.53) MAPTKDM4ETHRBSMN1; SMN2POLB
SCHEMBL7547636 0.83 DRD2 (0.46) MAPTTP53THRBLMNAALOX5
SCHEMBL7548181 0.83 CETP (0.46) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL7541510 0.83 AGPAT2 (0.50) MAPTTP53SMN1; SMN2MEN1KMT2A

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