⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4344895 | 0.80 | — | — | |
| SCHEMBL30680088 | 0.80 | — | — | |
| SCHEMBL7232241 | 0.80 | — | — | |
| SCHEMBL7168045 | 0.80 | — | — | |
| Water SCHEMBL10730329 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL28177100 | 0.78 | — | — | |
| Pyridine SCHEMBL28410148 | 0.69 | — | — | |
| SCHEMBL27775520 | 0.68 | — | — | |
| SCHEMBL31272550 | 0.67 | — | — | |
| SCHEMBL707402 | 0.65 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107827925-B | The method of Negishi reaction synthesis alpha-alkyl vinylphosphonic acid ester | 浙江医药高等专科学校 | 2019-10-18 | — | — | CN | claimed |
| CN-110003079-A | For making the ligand of imaging cardiac innervation | 兰休斯医疗成像公司 | 2019-07-12 | — | — | CN | disclosed |
| CN-105622463-B | For making the ligand of imaging cardiac innervation | 兰休斯医疗成像公司 | 2019-02-22 | — | — | CN | disclosed |
| US-8399667-B2 | 4-anilino quinazoline derivatives as antiproliferative agents | ASTRAZENECA AB (GB) | 2013-03-19 | — | — | US | disclosed |
| US-20100152442-A1 | 4-ANILINO QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS | ASTRAZENECA AB | 2010-06-17 | — | — | US | disclosed |