⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4729951 | 0.79 | — | — | |
| SCHEMBL4486306 | 0.79 | — | — | |
| SCHEMBL7976905 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL11786036 | 0.77 | L3MBTL1 (0.60) | — | |
| SCHEMBL9357016 | 0.74 | DAO (0.31) | — | |
| SCHEMBL13631428 | 0.74 | NPC1 (0.53) | — | |
| SCHEMBL3054665 | 0.73 | — | — | |
| SCHEMBL7068607 | 0.72 | L3MBTL1 (0.37) | — | |
| SCHEMBL7074073 | 0.72 | NR4A2 (0.38) | — | |
| SCHEMBL382018 | 0.71 | CA12 (0.53) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1231816-C | Photoresist compositions | SUMITOMO CHEMICAL CO (JP) | 2005-12-14 | — | — | CN | disclosed |
| EP-0945764-B1 | Photoresist composition | SUMITOMO CHEMICAL CO (JP) | 2003-06-18 | — | — | EP | disclosed |
| US-6258507-B1 | UNSATURATED AROMATIC ACRYLATED ESTER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2001-07-10 | — | — | US | disclosed |
| US-6114358-A | Thrombin inhibitors | BASF AKTIENGESELLSCHAFT (DE) | 2000-09-05 | — | — | US | disclosed |
| CN-1230704-A | Photoresist compositions | SUMITOMO CHEMICAL CO (JP) | 1999-10-06 | — | — | CN | disclosed |
| EP-0945764-A2 | Photoresist composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1999-09-29 | — | — | EP | disclosed |
| CN-1228783-A | Novel thrombin inhibitors | BASF AG (DE) | 1999-09-15 | — | — | CN | disclosed |
| US-3998960-A | ANALGESIC, ANTITUSSIVE, OPIATE ANTAGONIST | BOEHRINGER INGELHEIM GMBH (DT) | 1976-12-21 | — | — | US | disclosed |
| US-3962249-A | 1-(3-PHENYLPROPYL)-4-FUROYLPIPERAZINE DERIVATIVES | KYORIN SEIYAKU KABUSHIKI KAISHA (JA) | 1976-06-08 | — | — | US | disclosed |
| US-3931194-A | ANALGESIC, ANTITUSSIVE, OPIATE ANTAGONIST | BOEHRINGER INGELHEIM GMBH (DT) | 1976-01-06 | — | — | US | disclosed |