⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4606038 | 0.72 | DGAT1 (0.34) | — | |
| SCHEMBL7259371 | 0.70 | — | — | |
| SCHEMBL1094446 | 0.69 | — | — | |
| Ether SCHEMBL28065265 | 0.68 | — | — | |
| SCHEMBL2384972 | 0.67 | — | — | |
| SCHEMBL3867103 | 0.63 | — | — | |
| Pyrazine SCHEMBL2492066 | 0.61 | ALDH1A1 (0.33) | — | |
| Ether SCHEMBL10501726 | 0.58 | ALDH1A1 (0.41) | — | |
| Ether SCHEMBL18173787 | 0.58 | ALDH1A1 (0.41) | — | |
| Ether SCHEMBL10629462 | 0.58 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0835252-B1 | TRIAZOLE ANTIFUNGAL AGENTS | PFIZER RES & DEV (IE) | 2003-07-30 | — | — | EP | disclosed |
| US-6376526-B1 | FOR HUANS, ANIMALS | PFIZER INC. | 2002-04-23 | — | — | US | disclosed |
| EP-0796858-B1 | Triazole antifungal agents | PFIZER LTD (GB) | 2000-11-02 | — | — | EP | disclosed |
| US-6124325-A | Triazole antifungal agents | PFIZER INC. (US) | 2000-09-26 | — | — | US | disclosed |
| US-6015825-A | Triazole antifungal agents | PFIZER INC. (US) | 2000-01-18 | — | — | US | disclosed |
| US-5981560-A | 1,2,4-TRIAZOLE FUNGICIDES | PFIZER INC. (US) | 1999-11-09 | — | — | US | disclosed |
| EP-0835252-A1 | TRIAZOLE ANTIFUNGAL AGENTS | Pfizer Research and Development Company, N.V./S.A. (IE) | 1998-04-15 | — | — | EP | disclosed |
| EP-0796858-A1 | Triazole antifungal agents | Pfizer Limited (GB) | 1997-09-24 | — | — | EP | disclosed |
| WO-1997001552-A1 | TRIAZOLE ANTIFUNGAL AGENTS | PFIZER RESEARCH AND DEVELOPMENT COMPANY, N.V./S.A. (IE) | 1997-01-16 | — | — | WO | disclosed |