SCHEMBL4574475

SCHEMBL4574475

NC(=O)OC1CCN(CCO)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.43
CHRM3 P20309 9/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SLC18A3 Q16572 1/20 0.39
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
PKM P14618 1/20 0.38
NFKB1 P19838 1/20 0.38
THPO P40225 1/20 0.38
HIF1A Q16665 1/20 0.38
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
F2 P00734 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
ST14 Q9Y5Y6 1/20 0.38
ATM Q13315 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
SCHEMBL28886385 0.89 CHRM3 (0.41) CHRM3
SCHEMBL28662442 0.86 CHRM3 (0.44) CHRM3
SCHEMBL29285120 0.85 CHRM3 (0.48) CHRM3SMN1; SMN2TP53CYP1A2CYP3A4
SCHEMBL28667844 0.84 KDM4E (0.37) CHRM3SMN1; SMN2CYP2D6MEN1ALDH1A1
SCHEMBL28552734 0.84 CHRM3 (0.39) CHRM3SMN1; SMN2TP53CYP1A2CYP3A4
SCHEMBL28660967 0.84 TP53 (0.54) CHRM3SMN1; SMN2TP53CYP1A2CYP3A4
SCHEMBL28681265 0.82 CHRM3 (0.38) HRH3CHRM3MEN1ALDH1A1KMT2A
SCHEMBL27762899 0.81 CHRM3 (0.49) CHRM3
SCHEMBL28999420 0.81 SMN1; SMN2 (0.43) SMN1; SMN2SLC18A3TP53CYP1A2CYP3A4
SCHEMBL28681273 0.80 CHRM3 (0.52) CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117915903-A Compounds for the treatment of neurodegenerative, degenerative and metabolic disorders and uses thereof 佛罗里达大学研究基金会公司 2024-04-19 CN disclosed
CN-110950843-B Substituted benzamide derivatives and uses thereof 广东东阳光药业有限公司 2022-12-27 CN disclosed
CN-110963999-B 2, 3-dihydrobenzofuran amide derivative and application thereof 广东东阳光药业有限公司 2021-05-11 CN disclosed
CN-110963999-A 2, 3-dihydrobenzofuran amide derivative and application thereof 广东东阳光药业有限公司 2020-04-07 CN disclosed
CN-110950843-A Substituted benzamide derivatives and uses thereof 广东东阳光药业有限公司 2020-04-03 CN disclosed
WO-2008071964-A1 NAPHTHYRIDINE BACTERICIDES ASTRAZENECA AB (SE) 2008-06-19 WO disclosed