⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL423646 | 0.83 | THRB (0.30) | — | |
| SCHEMBL7938244 | 0.83 | ALDH1A1 (0.35) | — | |
| SCHEMBL7938196 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL45482 | 0.78 | THRB (0.36) | — | |
| SCHEMBL24470037 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL13616508 | 0.76 | THRB (0.35) | — | |
| SCHEMBL17460095 | 0.76 | THRB (0.35) | — | |
| SCHEMBL21291961 | 0.76 | THRB (0.35) | — | |
| SCHEMBL139205 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL7113288 | 0.76 | THRB (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10870896-B2 | Solid, particulate tanning agent preparations | LANXESS DEUTSCHLAND GMBH (DE) | 2020-12-22 | — | — | US | disclosed |
| US-9376729-B2 | Compositions comprising at least one compound containing a carbamoyl sulfonate group and use of the same as tanning agents | LANXESS DEUTSCHLAND GMBH (DE) | 2016-06-28 | — | — | US | disclosed |
| US-20140123399-A1 | SOLID, PARTICULATE TANNING AGENT PREPARATIONS | LANXESS DEUTSCHLAND GMBH (DE) | 2014-05-08 | — | — | US | disclosed |
| US-20130288066-A1 | COMPOSITIONS COMPRISING AT LEAST ONE COMPOUND CONTAINING A CARBAMOYL SULFONATE GROUP AND USE OF THE SAME AS TANNING AGENTS | LANXESS DEUTSCHLAND GMBH (DE) | 2013-10-31 | — | — | US | disclosed |
| US-6254644-B1 | LOW-METAL SALT TANNING WITH A REACTIVE ORGANIC TANNING AGENT, ALDEHYDES OR BISULPHITE-BLOCKED POLYISOCYANATES, AND RETANNING WITH POLYASPARTIC ACID AND/OR POLYASPARTAMIDES, FINISH OF POLYURETHANE AND/OR POLYESTERAMIDE | BAYER AKTIENGESELLSCHAFT (DE) | 2001-07-03 | — | — | US | disclosed |
| US-5820634-A | TREATING LEATHER WITH PRODUCT CONTAINING CARBAMOYL SULFONATE GROUPS FORMED BY REACTING POLYISOCYANANTE WITH POLYETHER ALCOHOL AND MINERAL TANNING AGENT | BAYER AKTIENGESELLSCHAFT (DE) | 1998-10-13 | — | — | US | disclosed |
| US-5739249-A | POLYUREAURETHANE COPOLYMER | BAYER AKTIENGESELLSCHAFT (DE) | 1998-04-14 | — | — | US | disclosed |
| US-5618317-A | CARBAMOYL SULFONATE GROUP-CONTAINING REACTION PRODUCT OF ORGANIC POLYISOCYANATE, POLYETHER ALCOHOL, AMMONIUM OR ALKALI METAL BISULFITE OR DISULFITE | BAYER AKTIENGESELLSCHAFT (DE) | 1997-04-08 | — | — | US | disclosed |
| US-5503714-A | POLYISOCYANATES HAVING TERTIARY AMINO OR AMMONIUM GROUPS; WET AND DRY STRENGTH | BAYER AKTIENGESELLSCHAFT (DE) | 1996-04-02 | — | — | US | disclosed |