SCHEMBL28484267

SCHEMBL28484267

[Zn]CCCOC1CCCCO1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
KDM4C Q9H3R0 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
P2RX3 P56373 2/20 0.31
TGFBR1 P36897 1/20 0.31
KCNH2 Q12809 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30

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
Bromide SCHEMBL20703446 0.98 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL11024894 0.90 MEN1 (0.54) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL16376197 0.88 MEN1 (0.56) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL8361313 0.86 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL22922185 0.84 MEN1 (0.54) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL10742413 0.84 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL23544814 0.81 MEN1 (0.46) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL17859853 0.81 MEN1 (0.48) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL8971720 0.81 MEN1 (0.48) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL811117 0.81 MEN1 (0.51) MEN1KMT2AKDM4CL3MBTL1NPC1

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
CN-113453681-A Substituted 3- ((3-aminophenyl) amino) piperidine-2, 6-dione compounds, compositions thereof, and methods of treatment using the same 细胞基因公司 2021-09-28 CN disclosed
CN-111971277-A Benzothiophenes and related compounds as STING agonists 默沙东公司 2020-11-20 CN disclosed