SCHEMBL3434909

SCHEMBL3434909

CC(C)(C)OC(=O)N1CCCC[C@@H]1O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.48
HPGD P15428 1/20 0.47
EPHX1 P07099 1/20 0.45
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
CHRM3 P20309 1/20 0.45
PREP P48147 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PDE8B O95263 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
SCHEMBL12486284 1.00 HSD17B10 (0.48) HSD17B10HPGDEPHX1CHRM2CHRM1
SCHEMBL1427524 1.00 HSD17B10 (0.48) HSD17B10HPGDEPHX1CHRM2CHRM1
Methane SCHEMBL6697096 0.98 HSD17B10 (0.47) HSD17B10HPGDEPHX1CHRM2CHRM1
SCHEMBL29126181 0.98 HPGD (0.50) HSD17B10HPGDEPHX1CHRM2CHRM1
SCHEMBL31459726 0.98 HPGD (0.50) HSD17B10HPGDEPHX1CHRM2CHRM1
SCHEMBL1115598 0.95 HSD17B10 (0.52) HSD17B10HPGDEPHX1CHRM2CHRM1
SCHEMBL559852 0.95 HSD17B10 (0.52) HSD17B10HPGDEPHX1CHRM2CHRM1
SCHEMBL1010839 0.95 HSD17B10 (0.52) HSD17B10HPGDEPHX1CHRM2CHRM1
SCHEMBL1550543 0.95 HSD17B10 (0.52) HSD17B10HPGDEPHX1CHRM2CHRM1
Methane SCHEMBL667082 0.93 HSD17B10 (0.51) HSD17B10HPGDEPHX1CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114410619-B Method for synthesizing (S) -N-Boc-hydroxy piperidine by immobilized biocatalyst 东南大学成贤学院 2023-12-15 CN claimed
CN-114410619-A Method for synthesizing (S) -N-Boc-hydroxypiperidine by immobilized biocatalyst 东南大学成贤学院 2022-04-29 CN claimed
CN-114410619-B Method for synthesizing (S) -N-Boc-hydroxy piperidine by immobilized biocatalyst 东南大学成贤学院 2023-12-15 CN disclosed
CN-114410619-B Method for synthesizing (S) -N-Boc-hydroxy piperidine by immobilized biocatalyst 东南大学成贤学院 2023-12-15 CN disclosed
CN-114410619-B Method for synthesizing (S) -N-Boc-hydroxy piperidine by immobilized biocatalyst 东南大学成贤学院 2023-12-15 CN disclosed
CN-114410619-A Method for synthesizing (S) -N-Boc-hydroxypiperidine by immobilized biocatalyst 东南大学成贤学院 2022-04-29 CN disclosed
CN-114410619-A Method for synthesizing (S) -N-Boc-hydroxypiperidine by immobilized biocatalyst 东南大学成贤学院 2022-04-29 CN disclosed
CN-114410619-A Method for synthesizing (S) -N-Boc-hydroxypiperidine by immobilized biocatalyst 东南大学成贤学院 2022-04-29 CN disclosed
CN-105821013-B Carbonyl reductase and its application in the chiral N-protected-hydroxyl azacyclo- of preparation 华东理工大学 2019-05-03 CN disclosed
CN-109232581-A The method for replacing Buddhist nun's intermediate according to Shandong is isolated and purified with zinc chloride 福建省微生物研究所 2019-01-18 CN disclosed
CN-106967071-A It is a kind of according to Shandong replace Buddhist nun's intermediate isolation and purification method 福建省微生物研究所 2017-07-21 CN disclosed
CN-105821013-A Carbonyl reductase and application thereof in preparation of Chiral N-protecting-hydroxy nitrogen heterocycle 华东理工大学 2016-08-03 CN disclosed
EP-2220086-A2 DIPEPTIDYL PEPTIDASE-IV INHIBITING COMPOUNDS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS ACTIVE AGENT LG Life Sciences Ltd. (KR) 2010-08-25 EP disclosed
WO-2009082134-A2 DIPEPTIDYL PEPTIDASE-IV INHIBITING COMPOUNDS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS ACTIVE AGENT LG LIFE SCIENCES, LTD. (KR) 2009-07-02 WO disclosed