⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6728816 | 0.75 | — | — | |
| SCHEMBL6724960 | 0.75 | — | — | |
| SCHEMBL6720424 | 0.75 | — | — | |
| SCHEMBL6721952 | 0.75 | — | — | |
| SCHEMBL1058273 | 0.72 | PLA2G4A (0.38) | — | |
| SCHEMBL5182987 | 0.71 | — | — | |
| SCHEMBL244110 | 0.69 | — | — | |
| SCHEMBL92062 | 0.69 | — | — | |
| SCHEMBL185832 | 0.69 | — | — | |
| SCHEMBL6722115 | 0.69 | — | — |
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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4069243-A | Preparation of trifluoromethylthioacetic acid and its esters | SMITHKLINE CORPORATION (US) | 1978-01-17 | — | — | US | claimed |
| JP-57072987-A | — | — | None | — | — | JP | disclosed |
| JP-57072974-A | — | — | None | — | — | JP | disclosed |
| JP-56122344-A | — | — | None | — | — | JP | disclosed |
| US-11753436-B2 | Analogs of celastrol | ERX PHARMACEUTICALS CORPORATION (US) | 2023-09-12 | — | — | US | disclosed |
| US-20210000841-A1 | COMPOUNDS THAT MODULATE VON WILLEBRAND FACTOR LEVELS AND THEIR USE IN THE TREATMENT OF BLOOD DISORDERS | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 2021-01-07 | — | — | US | disclosed |
| US-20040097728-A1 | Method for producing anellated tetrahydro-{1h}-triazoles | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-20 | — | — | US | disclosed |
| US-6737544-B1 | HEATING ABOVE MELTING POINT | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-18 | — | — | US | disclosed |
| US-6639070-B1 | 4-substituted 1,3,4-oxadiazines; herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2003-10-28 | — | — | US | disclosed |
| EP-1187819-B1 | N-SUBSTITUTED PERHYDRO DIAZINE | BASF AG (DE) | 2003-07-23 | — | — | EP | disclosed |
| US-4259326-A | ANTIBIOTICS, BACTERICIDES | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1981-03-31 | — | — | US | disclosed |
| US-4139618-A | Cephalosporin type antibacterials | SYNTEX (U.S.A.) INC. (US) | 1979-02-13 | — | — | US | disclosed |
| US-4069243-A | Preparation of trifluoromethylthioacetic acid and its esters | SMITHKLINE CORPORATION (US) | 1978-01-17 | — | — | US | disclosed |
| US-4069243-A | Preparation of trifluoromethylthioacetic acid and its esters | SMITHKLINE CORPORATION (US) | 1978-01-17 | — | — | US | disclosed |
| US-4069243-A | Preparation of trifluoromethylthioacetic acid and its esters | SMITHKLINE CORPORATION (US) | 1978-01-17 | — | — | US | disclosed |
| US-4053468-A | PROCESS FOR PREPARING 7-OXO CEPHALOSPORINS AND 6-OXO PENICILLINS | SMITHKLINE CORPORATION (US) | 1977-10-11 | — | — | US | disclosed |
| US-4028408-A | Novel preparation of trifluoromethylthioacetic acid | SMITHKLINE CORPORATION (US) | 1977-06-07 | — | — | US | disclosed |
| US-4028408-A | Novel preparation of trifluoromethylthioacetic acid | SMITHKLINE CORPORATION (US) | 1977-06-07 | — | — | US | disclosed |
| US-4028408-A | Novel preparation of trifluoromethylthioacetic acid | SMITHKLINE CORPORATION (US) | 1977-06-07 | — | — | US | disclosed |
| US-3983113-A | Cephalosporin type antibacterials | SYNTEX (U.S.A.) INC. (US) | 1976-09-28 | — | — | US | disclosed |