⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11359076 | 0.73 | — | — | |
| SCHEMBL6302822 | 0.69 | — | — | |
| SCHEMBL7750535 | 0.66 | — | — | |
| SCHEMBL8974596 | 0.61 | — | — | |
| Potassium Ion SCHEMBL8096267 | 0.60 | — | — | |
| SCHEMBL6305409 | 0.57 | — | — | |
| Nitric Acid SCHEMBL11589777 | 0.52 | — | — | |
| SCHEMBL28664166 | 0.52 | MEN1 (0.33) | — | |
| SCHEMBL6888739 | 0.51 | GPR35 (0.30) | — | |
| Nitric Acid SCHEMBL3963735 | 0.51 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1064241-B1 | PRIMARY EXPLOSIVES AND PRIMERS WHICH CAN BE IGNITED BY ELECTRIC TRIGGERING | DELPHI TECH INC (US) | 2007-08-08 | — | — | EP | claimed |
| US-6946042-B2 | free of harmful materials, primary explosive such as atoxic metal cations of a mono- and a dinitrohydroxydiazobenzene (\"diazinate\") or dinitrofuroxan, a ditetrazole compound | KOEHLER JOSEF | 2005-09-20 | — | — | US | disclosed |
| US-20050178484-A1 | PYROTECHNIC BODY | KOHLER JOSEF (AT) | 2005-08-18 | — | — | US | disclosed |