⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8219036 | 1.00 | — | — | |
| SCHEMBL9787989 | 0.82 | — | — | |
| SCHEMBL20981749 | 0.80 | TSHR (0.35) | — | |
| SCHEMBL20981751 | 0.80 | TSHR (0.35) | — | |
| SCHEMBL20981797 | 0.80 | — | — | |
| SCHEMBL20981798 | 0.80 | — | — | |
| SCHEMBL15611716 | 0.77 | TSHR (0.34) | — | |
| SCHEMBL15611717 | 0.77 | TSHR (0.34) | — | |
| SCHEMBL21144972 | 0.77 | TSHR (0.31) | — | |
| SCHEMBL21144974 | 0.77 | TSHR (0.31) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4249114-A1 | NICKEL-COPPER-MANGANESE HYDROGENATION CATALYST COMPRISING A SILICA SUPPORT | BASF SE (DE) | 2023-09-27 | — | — | EP | claimed |
| EP-3878831-A1 | IMPROVED NICKEL-COPPER-MANGANESE-CATALYST FOR THE PREPARATION OF ALCOHOLS BY HYDROGENATION OF THE CORRESPONDING ALDEHYDES AND KETONES | BASF SE (DE) | 2021-09-15 | — | — | EP | claimed |
| EP-4249114-A1 | NICKEL-COPPER-MANGANESE HYDROGENATION CATALYST COMPRISING A SILICA SUPPORT | BASF SE (DE) | 2023-09-27 | — | — | EP | disclosed |
| EP-3878831-A1 | IMPROVED NICKEL-COPPER-MANGANESE-CATALYST FOR THE PREPARATION OF ALCOHOLS BY HYDROGENATION OF THE CORRESPONDING ALDEHYDES AND KETONES | BASF SE (DE) | 2021-09-15 | — | — | EP | disclosed |
| US-20190241822-A1 | COMPOSITION FOR REMOVING IRON SULFIDE | KURARAY CO., LTD. (JP) | 2019-08-08 | — | — | US | disclosed |
| EP-3486353-A1 | COMPOSITION FOR REMOVING IRON SULFIDE | Kuraray Co., Ltd. (JP) | 2019-05-22 | — | — | EP | disclosed |
| CN-109415819-A | For removing the composition of iron sulfide | 株式会社可乐丽 | 2019-03-01 | — | — | CN | disclosed |
| EP-2925714-B1 | METHOD FOR THE CATALYTIC ALDOL CONDENSATION OF ALDEHYDES | BASF SE (DE) | 2016-11-16 | — | — | EP | disclosed |
| US-9006495-B2 | Process for the catalytic aldol condensation of aldehydes | BASF SE (DE) | 2015-04-14 | — | — | US | disclosed |
| US-20140155656-A1 | Process for the Catalytic Aldol Condensation of Aldehydes | BASF SE (DE) | 2014-06-05 | — | — | US | disclosed |
| US-20130065969-A9 | Odour Compounds | GIVAUDAN SA (CH) | 2013-03-14 | — | — | US | disclosed |
| US-20120184630-A1 | Odour Compounds | KRAFT PHILIP (CH) | 2012-07-19 | — | — | US | disclosed |
| EP-2475639-A2 | ODOUR COMPOUNDS | Givaudan SA (CH) | 2012-07-18 | — | — | EP | disclosed |
| WO-2011029895-A2 | ODOUR COMPOUNDS | GIVAUDAN SA (CH) | 2011-03-17 | — | — | WO | disclosed |
| US-5691366-A | UNSATURATED NITRO OXIME FORMED BY REACTION OF DINITROGEN TRIOXIDE WITH DIOLEFIN ETHER, SULFIDE OR AMINE TO BE USED AS VASODILATORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-11-25 | — | — | US | disclosed |
| US-5495023-A | VASODILATORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-02-27 | — | — | US | disclosed |
| EP-0612315-A1 | NITRO COMPOUNDS HAVING VASODILATOR ACTIVITY | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-08-31 | — | — | EP | disclosed |
| US-5227544-A | Purity, distillation of butyraldehyde reactant | BASF CORPORATION (US) | 1993-07-13 | — | — | US | disclosed |
| WO-1993010097-A1 | NITRO COMPOUNDS HAVING VASODILATOR ACTIVITY | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1993-05-27 | — | — | WO | disclosed |