⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL731913 | 0.97 | — | — | |
| Water SCHEMBL27595950 | 0.94 | — | — | |
| Ethane SCHEMBL21591807 | 0.80 | TSHR (0.37) | — | |
| Ethane SCHEMBL10979758 | 0.76 | — | — | |
| SCHEMBL9099838 | 0.74 | — | — | |
| SCHEMBL29463955 | 0.73 | — | — | |
| SCHEMBL6764040 | 0.72 | — | — | |
| SCHEMBL3382447 | 0.72 | — | — | |
| SCHEMBL372653 | 0.72 | — | — | |
| SCHEMBL2063071 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016193309-A1 | NEW BIS ESTERS OF IVY SAPOGENINS FOR RUMINANTS | DSM IP ASSETS B.V. (NL) | 2016-12-08 | — | — | WO | disclosed |
| WO-2008077453-A1 | 5-FLUOROURACIL DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CANCER | SULFIDRIS, S.R.L. (IT) | 2008-07-03 | — | — | WO | disclosed |
| EP-1939186-A1 | 5-Fluorouracil derivatives and their use for the treatment of cancer | Sulfidris S.r.l. (IT) | 2008-07-02 | — | — | EP | disclosed |
| US-6150524-A | MORPHINAN DERIVATIVES | CENES LTD. (GB) | 2000-11-21 | — | — | US | disclosed |
| EP-0960111-A1 | MORPHINE DERIVATIVES WITH ANALGESIC ACTIVITY | NYCOMED IMAGING AS (NO) | 1999-12-01 | — | — | EP | disclosed |
| WO-1997022606-A1 | MORPHINE DERIVATIVES WITH ANALGESIC ACTIVITY | NYCOMED IMAGING AS (NO) | 1997-06-26 | — | — | WO | disclosed |
| US-5153226-A | Administering as anticholesterol agents, for atherosclerosis | WARNER-LAMBERT COMPANY (US) | 1992-10-06 | — | — | US | disclosed |
| EP-0415413-A1 | Acat inhibitors | WARNER-LAMBERT COMPANY (US) | 1991-03-06 | — | — | EP | disclosed |
| EP-0094776-B1 | NOVEL PROCESS FOR THE PREPARATION OF BIOTIN | PFIZER INC. (US) | 1988-06-22 | — | — | EP | disclosed |