⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4340953 | 1.00 | — | — | |
| Trimethylammonium SCHEMBL27625258 | 0.90 | SLC22A6 (0.36) | — | |
| SCHEMBL288510 | 0.84 | SLC22A6 (0.50) | — | |
| Hydrochloric Acid SCHEMBL7372643 | 0.81 | SLC22A6 (0.47) | — | |
| SCHEMBL28799207 | 0.81 | SLC22A6 (0.47) | — | |
| SCHEMBL6734053 | 0.81 | SLC22A6 (0.47) | — | |
| SCHEMBL2029778 | 0.77 | — | — | |
| SCHEMBL288980 | 0.77 | — | — | |
| SCHEMBL6664634 | 0.77 | ENPEP (0.46) | — | |
| SCHEMBL287858 | 0.77 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1735588-B | Synthesis for (R) and (S)-aminocarnitine and derivatives thereof from D-and L-aspartic acid | SIGMA TAU IND FARMACEUTI | 2010-05-26 | — | — | CN | disclosed |
| EP-1581475-B1 | SYNTHESIS OF (R) AND (S)-AMINOCARNITINE AND DERIVATIVES THEREOF FROM D-AND L-ASPARTIC ACID | SIGMA TAU IND FARMACEUTI (IT) | 2009-09-16 | — | — | EP | disclosed |
| CN-1735588-A | Synthesis for (R) and (S)-aminocarnitine and derivatives thereof from D-and L-aspartic acid | SIGMA TAU IND FARMACEUTI (IT) | 2006-02-15 | — | — | CN | disclosed |
| EP-1581475-A1 | SYNTHESIS OF (R) AND (S)-AMINOCARNITINE AND DERIVATIVES THEREOF FROM D-AND L-ASPARTIC ACID | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 2005-10-05 | — | — | EP | disclosed |
| US-6822115-B2 | VIA DIRECT HYDROLYSIS OF THE CHIRAL AMINOCARNITINE ESTER IN AN ACIDIC MILIEU TO YIELD A CHIRAL AMINOCARNITINE INNER SALT WITHOUT PURIFYING THE INTERMEDIATE PRODUCTS; PURITY OF >99%; RESOLUTION; ENZYME INHIBITOR OF CARNITINE PALMOYL TRANSFERASE | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2004-11-23 | — | — | US | disclosed |
| WO-2004063143-A1 | SYNTHESIS FO (R) AND (S)-AMINOCARNITINE AND DERIVATIVES THEREOF FROM D-AND L-ASPARTIC ACID | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2004-07-29 | — | — | WO | disclosed |
| US-20030153783-A1 | Synthesis of (R) and (S)-aminocarnitine, (R) and (S)-4-phosphonium-3-amino-butanoate, (R) and (S) 3,4-diaminobutanoic acid, and their derivatives starting from D- and L-aspartic acid | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. | 2003-08-14 | — | — | US | disclosed |
| US-20030153784-A1 | Synthesis of (R) and (S)-aminocarnitine, (R) and (S)-4-phosphonium-3-amino-butanoate, (R) and (S) 3,4-diaminobutanoic acid, and their derivatives starting from D- and L-aspartic acid | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2003-08-14 | — | — | US | disclosed |