⚠ 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 | |
|---|---|---|---|---|
| Carbon Dioxide SCHEMBL4792172 | 0.82 | — | — | |
| Carbon Dioxide SCHEMBL3993612 | 0.78 | — | — | |
| Carbon Tetrachloride SCHEMBL11300203 | 0.78 | — | — | |
| Dichlorodifluoromethane SCHEMBL485 | 0.78 | — | — | |
| Dichlorodifluoromethane SCHEMBL14722383 | 0.78 | — | — | |
| Dichlorodifluoromethane SCHEMBL10828892 | 0.78 | TSHR (0.43) | — | |
| SCHEMBL465578 | 0.76 | — | — | |
| SCHEMBL3745844 | 0.76 | — | — | |
| Carbon Dioxide SCHEMBL3200171 | 0.74 | — | — | |
| Carbon Dioxide SCHEMBL22204693 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20140088081-A1 | Amino-Heterocyclic Compounds | PFIZER INC. (US) | 2014-03-27 | — | — | US | disclosed |
| US-8618117-B2 | Amino-heterocyclic compounds | PFIZER INC. (US) | 2013-12-31 | — | — | US | disclosed |
| EP-2389382-B1 | Amino-heterocyclic compounds used as pde9 inhibitors | PFIZER (US) | 2013-06-05 | — | — | EP | disclosed |
| US-20120329777-A1 | Amino-Heterocyclic Compounds | PFIZER INC. | 2012-12-27 | — | — | US | disclosed |
| US-8278295-B2 | Amino-heterocyclic compounds | PFIZER INC. (US) | 2012-10-02 | — | — | US | disclosed |
| US-20100190771-A1 | AMINO-HETEROCYCLIC COMPOUNDS | PFIZER INC. | 2010-07-29 | — | — | US | disclosed |
| EP-0116624-B1 | PROCESS FOR OLEFIN OXIDE DETOXIFICATION | BUONICORE-CASHMAN ASSOCIATES, INC. (US) | 1987-04-15 | — | — | EP | disclosed |
| EP-0116624-A4 | PROCESS FOR OLEFIN OXIDE DETOXIFICATION. | BUONICORE CASHMAN ASS INC (US) | 1985-03-06 | — | — | EP | disclosed |
| EP-0116624-A1 | PROCESS FOR OLEFIN OXIDE DETOXIFICATION. | BUONICORE CASHMAN ASS INC (US) | 1984-08-29 | — | — | EP | disclosed |
| WO-1984000748-A1 | PROCESS FOR OLEFIN OXIDE DETOXIFICATION | BUONICORE CASHMAN ASS INC (US) | 1984-03-01 | — | — | WO | disclosed |