SCHEMBL7067688

SCHEMBL7067688

O=C(O)C1CCN1C(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.54
ALDH1A1 P00352 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 4/20 0.50
ACHE P22303 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
HPGD P15428 1/20 0.47
EPHX1 P07099 1/20 0.46
L3MBTL3 Q96JM7 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL5701961 1.00 CA2 (0.54) CA2ALDH1A1TDP1L3MBTL1ACHE
SCHEMBL5701920 1.00 CA2 (0.54) CA2ALDH1A1TDP1L3MBTL1ACHE
SCHEMBL7879782 0.98 CA2 (0.52) CA2ALDH1A1TDP1L3MBTL1ACHE
Water SCHEMBL7879777 0.96 CA2 (0.51) CA2ALDH1A1TDP1L3MBTL1ACHE
SCHEMBL5702058 0.90 HPGD (0.54) CA2ALDH1A1TDP1L3MBTL1SMN1; SMN2
SCHEMBL5702038 0.90 HPGD (0.54) CA2ALDH1A1TDP1L3MBTL1SMN1; SMN2
SCHEMBL13230 0.89 CA2 (0.67) CA2ALDH1A1TDP1L3MBTL1SMN1; SMN2
SCHEMBL13229 0.89 CA2 (0.67) CA2ALDH1A1TDP1L3MBTL1SMN1; SMN2
SCHEMBL28789388 0.89 CA2 (0.67) CA2ALDH1A1TDP1L3MBTL1SMN1; SMN2
SCHEMBL3575904 0.88 TDP1 (0.66) CA2ALDH1A1TDP1L3MBTL1SMN1; 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

Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1003885-A1 MICROORGANISM AND ESTERASE OBTAINED THEREFROM Chirotech Technology Limited (GB) 2000-05-31 EP claimed
WO-1999004015-A1 MICROORGANISM AND ESTERASE OBTAINED THEREFROM CHIROTECH TECHNOLOGY LIMITED (GB) 1999-01-28 WO claimed
EP-2576803-B1 PREPARATION OF (3aS,7aR)-HEXAHYDROISOBENZOFURAN-1(3H)-ONE BY CATALYZED BIOLOGICAL RESOLUTION OF DIMETHYL CYCLOHEXANE-1,2-DICARBOXYLATE BGP PRODUCTS OPERATIONS GMBH (CH) 2019-07-10 EP disclosed
EP-0912755-B1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRAZENECA AB (SE) 2003-06-04 EP disclosed
EP-0970049-B1 PROCESS FOR THE PRODUCTION OF ENANTIOMERICALLY ENRICHED N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRAZENECA AB (SE) 2002-06-05 EP disclosed
US-6333418-B1 Cyclisation process ASTRAZENECA AB (SE) 2001-12-25 US disclosed
US-6313315-B1 RESOLUTION; ENANTIOMORPHIC PURIFICATION; CRYSTALLIZATION IN SOLVENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-06 US disclosed
EP-1098876-A1 CYCLISATION PROCESS AstraZeneca AB (SE) 2001-05-16 EP disclosed
EP-1057810-A1 Method for producing n-protected-azetidine-2-carboxylic acids SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-12-06 EP disclosed
US-6136591-A Bioresolution of N-acylazetidine-2-carboxylic acids ASTRA AB (SE) 2000-10-24 US disclosed
EP-1003885-A1 MICROORGANISM AND ESTERASE OBTAINED THEREFROM Chirotech Technology Limited (GB) 2000-05-31 EP disclosed
EP-1003885-A1 MICROORGANISM AND ESTERASE OBTAINED THEREFROM Chirotech Technology Limited (GB) 2000-05-31 EP disclosed
US-6054594-A Process for the production of enantiomerically enriched N-acylazetidine-2-carboxylic acids ASTRA AB (SE) 2000-04-25 US disclosed
WO-2000003982-A1 CYCLISATION PROCESS ASTRAZENECA AB (SE) 2000-01-27 WO disclosed
EP-0970049-A1 PROCESS FOR THE PRODUCTION OF ENANTIOMERICALLY ENRICHED $i(N)-ACYLAZETIDINE-2-CARBOXYLIC ACIDS Astra Aktiebolag (SE) 2000-01-12 EP disclosed
EP-0912755-A1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS Astra Aktiebolag (SE) 1999-05-06 EP disclosed
WO-1999004015-A1 MICROORGANISM AND ESTERASE OBTAINED THEREFROM CHIROTECH TECHNOLOGY LIMITED (GB) 1999-01-28 WO disclosed
WO-1999004015-A1 MICROORGANISM AND ESTERASE OBTAINED THEREFROM CHIROTECH TECHNOLOGY LIMITED (GB) 1999-01-28 WO disclosed
WO-1998002417-A1 PROCESS FOR THE PRODUCTION OF ENANTIOMERICALLY ENRICHED N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRA AKTIEBOLAG (SE) 1998-01-22 WO disclosed
WO-1998002568-A1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRA AKTIEBOLAG (SE) 1998-01-22 WO disclosed