SCHEMBL123032

SCHEMBL123032

CC(C)(C)OC(=O)N1CCC(=O)C1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.54
NR1H2 P55055 2/20 0.52
ADORA1 P30542 2/20 0.49
USP2 O75604 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPK1 P28482 1/20 0.46
MAPT P10636 4/20 0.43
KDM4E B2RXH2 2/20 0.42
THRB P10828 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
PDK4 Q16654 1/20 0.42
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
HPGD P15428 1/20 0.41
PARP1 P09874 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
PARP2 Q9UGN5 1/20 0.41

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
Methyl Alcohol SCHEMBL28603193 0.98 ESR2 (0.52) ESR2NR1H2ADORA1USP2SMN1; SMN2
Acetonitrile SCHEMBL29109665 0.92 NR1H2 (0.50) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL13160 0.89 ESR2 (0.48) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL27669441 0.89 USP2 (0.56) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL14800964 0.89 USP2 (0.52) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL31028 0.89 USP2 (0.56) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL1336913 0.88 HPGD (0.49) ESR2NR1H2ADORA1USP2SMN1; SMN2
Ammonia Solution, Strong SCHEMBL27841683 0.87 USP2 (0.55) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL30707004 0.86 HPGD (0.51) ESR2NR1H2ADORA1USP2SMN1; SMN2
Ethylene SCHEMBL3832936 0.85 USP2 (0.53) ESR2NR1H2ADORA1USP2SMN1; SMN2

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

Appears in 3346 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117777136-B 1, 3-Disubstituted tetrahydropyrrole derivative and preparation method and application thereof 沈阳药科大学 2025-04-29 CN claimed
CN-119753050-A Preparation method of 3-ketotetrahydrofuran 中国科学院青岛生物能源与过程研究所 2025-04-04 CN claimed
CN-119614650-A R-aminotransferase and application thereof in asymmetric synthesis of chiral N-heterocyclic amine compound 沈阳药科大学 2025-03-14 CN claimed
CN-119592535-A Omega-aminotransferase ancestral enzyme mutant for efficiently catalyzing and synthesizing (R) -chiral amine compound and application thereof 浙江科技大学 2025-03-11 CN claimed
CN-119574680-A Mass spectrum detection method for N-heterocyclic ketone and/or N-heterocyclic chiral amino compound and application thereof 北京衍微科技有限公司 2025-03-07 CN claimed
CN-119023611-A Real-time monitoring method for ketone-amine conversion reaction process and application thereof 北京衍微科技有限公司 2024-11-26 CN claimed
CN-116103257-B Reductive amination enzyme mutant and application thereof in synthesis of alkylated pyrrolidine chiral amine 中国科学院天津工业生物技术研究所 2024-10-29 CN claimed
CN-118755684-A Catalytic enzyme for producing chiral aromatic amine, N-heterocyclic amine and derivatives thereof with high optical purity, and preparation method and application thereof 杭州微远生物科技有限公司 2024-10-11 CN claimed
CN-115974746-B Synthesis method of tosufloxacin tosylate intermediate 天地恒一制药股份有限公司 2024-10-01 CN claimed
CN-114277008-B (R) -selective transaminase and application thereof 弈柯莱生物科技(集团)股份有限公司 2024-09-24 CN claimed
EP-1987152-B1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE CHIRAL AMINES LONZA AG (CH) 2010-05-26 EP claimed
US-20090246837-A1 Process for The Preparation of Optically Active Chiral Amines LONZA AG (CH) 2009-10-01 US claimed
CN-101384723-A Process for the preparation of optically active chiral amines LONZA AG (CH) 2009-03-11 CN claimed
EP-1987152-A1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE CHIRAL AMINES Lonza AG (CH) 2008-11-05 EP claimed
EP-1897956-A1 Process for preparation of optically active amines by optical resolution of racemic amines employing a bacterial omega-transaminase Lonza AG (CH) 2008-03-12 EP claimed
WO-2007093372-A1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE CHIRAL AMINES LONZA AG (CH) 2007-08-23 WO claimed
EP-1818411-A1 Process for the preparation of optically active chiral amines Lonza AG (CH) 2007-08-15 EP claimed
US-20070049594-A1 Novel compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2007-03-01 US claimed
US-20050288316-A1 Beta-carbolines as growth hormone secretagogue receptor (GHSR) antagonists BIOVITRUM AB (SE) 2005-12-29 US claimed
WO-2005048916-A2 TETRAHYDROSPIRO-BETA-CARBOLINE-1,3 '-PYRROLIDINE DERIVATIVES AND THEIR USE IN GHSR-RELATED DISORDERS BIOVITRUM AB (SE) 2005-06-02 WO claimed