SCHEMBL8666294

SCHEMBL8666294

COC(=O)Nc1ccc(OCc2nc3cccc(C(=O)OC)c3o2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 2/20 0.49
CETP P11597 1/20 0.48
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 5/20 0.39
ALDH1A1 P00352 3/20 0.39
POLB P06746 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL7544427 0.92 MEN1 (0.51) SMN1; SMN2NPC1RAB9ACETPMEN1
SCHEMBL7542905 0.86 SMN1; SMN2 (0.50) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL7543778 0.85 MAPT (0.45) SMN1; SMN2NPC1RAB9ACETPMEN1
SCHEMBL7542460 0.83 SMN1; SMN2 (0.49) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL7542952 0.81 SMN1; SMN2 (0.57) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL7547594 0.80 SMN1; SMN2 (0.47) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL7543899 0.79 MAPT (0.45) NPC1RAB9ACETPKMT2AKDM4E
SCHEMBL7543927 0.77 MAPT (0.56) SMN1; SMN2NPC1RAB9ACETPMAPT
SCHEMBL7541707 0.77 MAPT (0.52) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL7545924 0.77 MAPT (0.47) SMN1; SMN2NPC1RAB9ACETPLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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