SCHEMBL7993936

SCHEMBL7993936

CN(C(=O)OCC[Si](C)(C)C)c1ccc2oc(CC(C)(C)C)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.38
GAA P10253 2/20 0.36
AGPAT2 O15120 1/20 0.35
MAPT P10636 4/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 2/20 0.34
LMNA P02545 2/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
MPI P34949 1/20 0.33
BRCA1 P38398 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL7973936 0.87 MAPT (0.37) ACLYGAAMAPTNPC1RAB9A
SCHEMBL8001315 0.77 KDM4E (0.43) ACLYGAAAGPAT2MAPTNPC1
SCHEMBL7993937 0.76 GAA (0.43) ACLYGAAMAPTNPC1RAB9A
SCHEMBL7973939 0.74 GAA (0.41) ACLYGAAMAPTNPC1RAB9A
SCHEMBL7960612 0.74 NPC1 (0.38) ACLYGAAMAPTNPC1RAB9A
SCHEMBL5733868 0.69 NPC1 (0.45) ACLYGAAMAPTNPC1RAB9A
SCHEMBL7978062 0.68 CA12 (0.48) ACLYGAANPC1RAB9AKDM4E
SCHEMBL7997880 0.67 ESR1 (0.50) ACLYGAAMAPTNPC1RAB9A
SCHEMBL7972175 0.66 GAA (0.59) ACLYGAAMAPTNPC1RAB9A
SCHEMBL5733947 0.66 GAA (0.75) ACLYGAAMAPTKDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001055136-A1 BENZOXAZOLE DERIVATIVES AND THEIR USE AS PESTICIDES SYNGENTA LIMITED (GB) 2001-08-02 WO disclosed