SCHEMBL43366

SCHEMBL43366

COc1cccc2c1CCC(N)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 1.00
DRD3 P35462 9/20 1.00
ADRA1A P35348 1/20 0.65
DRD4 P21917 6/20 0.63
CHRM2 P08172 1/20 0.61
CHRM1 P11229 1/20 0.61
CHRM3 P20309 1/20 0.61
MTNR1A P48039 1/20 0.56
MTNR1B P49286 1/20 0.56
PLAU P00749 1/20 0.55

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
SCHEMBL29547385 1.00 DRD2 (1.00) DRD2DRD3ADRA1ADRD4CHRM2
SCHEMBL29429678 1.00 DRD2 (1.00) DRD2DRD3ADRA1ADRD4CHRM2
SCHEMBL895742 1.00 DRD2 (1.00) DRD2DRD3ADRA1ADRD4CHRM2
SCHEMBL895845 1.00 DRD2 (1.00) DRD2DRD3ADRA1ADRD4CHRM2
Hydrochloric Acid SCHEMBL6824058 0.98 DRD2 (0.97) DRD2DRD3ADRA1ADRD4CHRM2
Hydrochloric Acid SCHEMBL31672141 0.98 DRD2 (0.97) DRD2DRD3ADRA1ADRD4CHRM2
Hydrochloric Acid SCHEMBL6824054 0.98 DRD2 (0.97) DRD2DRD3ADRA1ADRD4CHRM2
Hydrochloric Acid SCHEMBL3468007 0.98 DRD2 (0.97) DRD2DRD3ADRA1ADRD4CHRM2
SCHEMBL9315535 0.90 DRD2 (0.82) DRD2DRD3ADRA1ADRD4CHRM2
SCHEMBL4210081 0.88 DRD2 (0.79) DRD2DRD3ADRA1ACHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023214011-A1 ENZYMATIC METHOD FOR PREPARING (R)-3-AMINO-4-ARYL-BUTANOIC ACID DERIVATIVES ENZYMICALS AG (DE) 2023-11-09 WO claimed
EP-4273254-A1 ENZYMATIC METHOD FOR PREPARING (R)-3-AMINO-4-ARYL-BUTANOIC ACID DERIVATIVES Enzymicals AG (DE) 2023-11-08 EP claimed
CN-113234057-B Preparation method of rotigotine 成都工业学院 2022-12-02 CN claimed
CN-113234057-A Preparation method of rotigotine 成都工业学院 2021-08-10 CN claimed
US-9879293-B2 Enzymatic transamination of cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2018-01-30 US claimed
EP-2623593-B1 NOVEL AMINOTRANSFERASE AND GENE ENCODING SAME, AND USE OF THE AMINOTRANSFERASE AND THE GENE KANEKA CORP (JP) 2017-07-12 EP claimed
EP-2022852-B1 METHOD FOR PRODUCTION OF OPTICALLY ACTIVE AMINE COMPOUND, RECOMBINANT VECTOR, AND TRANSFORMANT CARRYING THE VECTOR KANEKA CORP (JP) 2017-07-05 EP claimed
EP-2684953-B1 MODIFIED AMINOTRANSFERASE, GENE THEREOF, AND METHOD FOR PRODUCING OPTICALLY ACTIVE AMINO COMPOUND USING SAME KANEKA CORP (JP) 2017-06-28 EP claimed
EP-2623595-B1 NOVEL TRANSAMINASE SHOWING HIGH ACTIVITY FOR GLUTAMIC ACID, GENE ENCODING SAME, AND METHOD FOR UTILIZATION THEREOF KANEKA CORP (JP) 2016-11-02 EP claimed
US-9481870-B2 Nucleic acid encoding a polypeptide having aminotransferase activity, vectors and host cells comprising the nucleic acid KANEKA CORPORATION (JP) 2016-11-01 US claimed
US-20090148899-A1 METHOD FOR PRODUCING OPTICALLY-ACTIVE AMINE COMPOUND, RECOMBINANT VECTOR, AND TRANSFORMANT CONTAINING THE VECTOR KANEKA CORPORATION (JP) 2009-06-11 US claimed
EP-2022852-A1 METHOD FOR PRODUCTION OF OPTICALLY ACTIVE AMINE COMPOUND, RECOMBINANT VECTOR, AND TRANSFORMANT CARRYING THE VECTOR Kaneka Corporation (JP) 2009-02-11 EP claimed
EP-1981831-A2 KIT FOR AUTOMATED RESOLVING AGENT SELECTION AND METHOD THEREOF Vaidya, Niteen A. (US) 2008-10-22 EP claimed
EP-1889907-A1 NOVEL AMINO GROUP TRANSFERASE, GENE ENCODING THE SAME AND METHOD OF USING THE SAME Kaneka Corporation (JP) 2008-02-20 EP claimed
WO-2007092264-A2 KIT FOR AUTOMATED RESOLVING AGENT SELECTION AND METHOD THEREOF VAIDYA NITEEN A (US) 2007-08-16 WO claimed
US-20070185346-A1 Kit for automated resolving agent selection and method thereof VAIDYA NITEEN A 2007-08-09 US claimed
EP-1278885-B1 RESOLUTION OF AMINOTETRALINS TORCAN CHEMICAL LTD (CA) 2004-06-16 EP claimed
EP-1278885-A1 RESOLUTION OF AMINOTETRALINS TORCAN CHEMICAL Ltd (CA) 2003-01-29 EP claimed
WO-2001083807-A1 RESOLUTION OF AMINOTETRALINS TORCAN CHEMICAL LTD. (CA) 2001-11-08 WO claimed
US-6271005-B1 BY STEREOSPECIFIC ACYLATION BY THE ENZYME PSEUDOMONAS CEPACIA LIPASE OF ONE STEREOISOMER WHILE LEAVING THE OTHER UNCHANGED; 5-METHOXY-2-AMINOTETRALIN CHEMICAL INTERMEDIATES TO A 2-AMINOTETRALIN-ETHYLTHIOPHENE PARKINSON'S DRUG TORCAN CHEMICAL LIMITED (CA) 2001-08-07 US claimed