⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3991269 | 1.00 | — | — | |
| SCHEMBL1029944 | 1.00 | — | — | |
| SCHEMBL9755608 | 0.72 | FFAR3 (0.30) | — | |
| SCHEMBL5030208 | 0.69 | — | — | |
| SCHEMBL5320519 | 0.69 | — | — | |
| SCHEMBL4413029 | 0.69 | — | — | |
| SCHEMBL7754675 | 0.67 | — | — | |
| SCHEMBL6337686 | 0.67 | — | — | |
| SCHEMBL19415804 | 0.67 | TSHR (0.32) | — | |
| SCHEMBL17874833 | 0.67 | TSHR (0.32) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4699986-A | AZETIDINE INTERMEDIATES FOR ISOCEPHALOSPORINS | HOFMANN-LA ROCHE INC. (US) | 1987-10-13 | — | — | US | claimed |
| EP-0156976-B1 | OPTICALLY UNIFORM IMINES | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1987-09-30 | — | — | EP | claimed |
| US-7517876-B2 | Anti-infective agents | ABBOTT LABORATORIES (US) | 2009-04-14 | — | — | US | disclosed |
| US-20060287300-A1 | Anti-infective agents | ABBVIE INC. | 2006-12-21 | — | — | US | disclosed |
| WO-2006093801-A1 | THIADIAZINE DERIVATIVES USEFUL AS ANTI-INFECTIVE AGENTS | ABBOTT LABORATORIES (US) | 2006-09-08 | — | — | WO | disclosed |
| EP-1413627-A1 | Enzymatic synthesis of (S)-1,2-O-isopropylidene glycerol | PRIME EUROPEAN THERAPEUTICALS S.p.A., in abbreviated form EUTICALS S.p.A. (IT) | 2004-04-28 | — | — | EP | disclosed |
| US-5686250-A | PRODUCING ANTIBODIES SPECIFIC TO LEVUGLANDIN CARRIER-PROTEIN BOUND PYRROLE ADDUCTS | CASE WESTERN RESERVE UNIVERSITY (US) | 1997-11-11 | — | — | US | disclosed |
| US-4948898-A | MICROBIOCIDE DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 1990-08-14 | — | — | US | disclosed |
| US-4816582-A | BACTERICIDES, ANTIBIOTICS | HOFFMANN-LA ROCHE INC. (US) | 1989-03-28 | — | — | US | disclosed |
| US-4699986-A | AZETIDINE INTERMEDIATES FOR ISOCEPHALOSPORINS | HOFMANN-LA ROCHE INC. (US) | 1987-10-13 | — | — | US | disclosed |
| US-4652651-A | Process for the manufacture of 1-sulpho-2-oxoazetidine carboxylic acid intermediates via catalytic ester cleavage | HOFFMANN-LA ROCHE INC. (US) | 1987-03-24 | — | — | US | disclosed |
| US-4619787-A | Beta lactams | HOFFMANN-LA ROCHE INC. (US) | 1986-10-28 | — | — | US | disclosed |
| US-4617150-A | MICROBIOCIDES | HOFFMANN-LA ROCHE INC. (US) | 1986-10-14 | — | — | US | disclosed |
| US-4576751-A | ANTIBIOTICS | HOFFMAN-LA ROCHE INC. (US) | 1986-03-18 | — | — | US | disclosed |