SCHEMBL723197

SCHEMBL723197

CCC(O)c1ccccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
ALDH1A1 P00352 2/20 0.42
TSHR P16473 2/20 0.42
AOC3 Q16853 3/20 0.38
ALOX15 P16050 2/20 0.38
CYP3A4 P08684 2/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PDE2A O00408 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
HSD17B10 Q99714 1/20 0.36
NOS3 P29474 2/20 0.35
NOS1 P29475 2/20 0.35
NOS2 P35228 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
TRPA1 O75762 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL6834936 1.00 LMNA (0.50) LMNAALDH1A1TSHRAOC3ALOX15
Hydrochloric Acid SCHEMBL5981045 0.98 LMNA (0.48) LMNAALDH1A1TSHRAOC3ALOX15
Hydrochloric Acid SCHEMBL9992852 0.98 LMNA (0.48) LMNAALDH1A1TSHRAOC3ALOX15
Phosphoric Acid SCHEMBL18039304 0.91 LMNA (0.42) LMNAALDH1A1TSHRAOC3CYP3A4
Benzoic Acid SCHEMBL5981268 0.86 DAO (0.45) LMNAALDH1A1TSHRSMN1; SMN2
SCHEMBL30172716 0.84 LMNA (0.61) LMNATSHRAOC3PDE2ATRPA1
SCHEMBL5107133 0.84 LMNA (0.61) LMNATSHRAOC3PDE2ATRPA1
SCHEMBL5107130 0.84 LMNA (0.61) LMNATSHRAOC3PDE2ATRPA1
SCHEMBL5107136 0.84 LMNA (0.61) LMNATSHRAOC3PDE2ATRPA1
SCHEMBL2857703 0.83 AOC3 (0.41) LMNAALDH1A1TSHRAOC3ALOX15

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 107 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115066420-A Optically resolved Trolox intermediates and process for producing the same 住友制药株式会社 2022-09-16 CN claimed
JP-4806763-B2 2011-11-02 JP claimed
CN-100404527-C Chiral 4,4'-dimethoxy-5,6,5',6'-bis methylene dioxy -2,2'-phthalic acid derivatives and process for preparing same QUALITY INSPECTION AND ANALYSI (CN) 2008-07-23 CN claimed
CN-100357256-C Method for synthesizing o-aminophenylpropyl alcohol UNIV SHANGHAI (CN) 2007-12-26 CN claimed
EP-1497272-A4 METHOD OF PREPARING AMINE STEREOISOMERS APSINTERM LLC (US) 2007-02-07 EP claimed
EP-1735266-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE 1-ERYTHRO-2-AMINO-1-PHENYL-1-PROPANOL Emmellen Biotech Pharmaceuticals Limited (IN) 2006-12-27 EP claimed
CN-1837203-A Chiral 4,4'-dimethoxy-5,6,5',6'-bis methylene dioxy -2,2'-phthalic acid derivatives and process for preparing same QUALITY INSPECTION AND ANALYSI (CN) 2006-09-27 CN claimed
CN-1760173-A Method for synthesizing o-aminophenylpropyl alcohol UNIV SHANGHAI (CN) 2006-04-19 CN claimed
WO-2005100299-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE 1-ERYTHRO-2-AMINO-1-PHENYL-1-PROPANOL EMMELLEN BIOTECH PHARMACEUTICALS LIMITED (IN) 2005-10-27 WO claimed
CN-1659154-A Process for the preparation of amine stereoisomers APSINTERM LLC (US) 2005-08-24 CN claimed
EP-1497272-A2 METHOD OF PREPARING AMINE STEREOISOMERS Apsinterm, LLC. (US) 2005-01-19 EP claimed
WO-2003091207-A2 METHOD OF PREPARING AMINE STEREOISOMERS APSINTERM, LLC. (US) 2003-11-06 WO claimed
US-4045450-A Optical resolution of DL-pantolactone ALPS PHARMACEUTICAL IND. CO., LTD. (JA) 1977-08-30 US claimed
CN-115066420-B Optically resolved Trolox intermediates and methods of making the same PTC医疗公司 2024-12-10 CN disclosed
EP-3153482-B1 PLASTICIZER-CONTAINING HARDENING ACCELERATOR COMPOSITION CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2024-11-06 EP disclosed
US-20230357496-A1 AROMATIC POLYESTER POLYETHER POLYURETHANE PANELS AND USEFUL MATERIALS COMPRISING SAME Talaco Holdings, LLC 2023-11-09 US disclosed
US-4330476-A CONDENSATION OF AROMATIC ALDEHYDE WITH AROMATIC AMINE FOLLOWED BY OXIDATION BAYER AKTIENGESELLSCHAFT (DE) 1982-05-18 US disclosed
US-4318959-A POLYOLEFIN FIBERS AND STABILIZING CO-FILLERS MAMECO INTERNATIONAL, INC., 4475 E. 175TH STREET, CLEVELAND, OHIO 44128, A CORP. OF OHIO 1982-03-09 US disclosed
US-4045450-A Optical resolution of DL-pantolactone ALPS PHARMACEUTICAL IND. CO., LTD. (JA) 1977-08-30 US disclosed
US-4045450-A Optical resolution of DL-pantolactone ALPS PHARMACEUTICAL IND. CO., LTD. (JA) 1977-08-30 US disclosed