⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7963282 | 0.80 | — | — | |
| SCHEMBL7967645 | 0.79 | RNPEP (0.32) | — | |
| SCHEMBL3977096 | 0.78 | — | — | |
| SCHEMBL1462736 | 0.78 | TSHR (0.35) | — | |
| SCHEMBL6784597 | 0.78 | — | — | |
| SCHEMBL7963024 | 0.77 | ALDH1A1 (0.37) | — | |
| SCHEMBL503862 | 0.76 | — | — | |
| SCHEMBL1888949 | 0.76 | — | — | |
| SCHEMBL9745532 | 0.76 | — | — | |
| SCHEMBL7968207 | 0.76 | — | — |
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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2010500158-A | — | — | 2010-01-07 | — | — | JP | claimed |
| EP-2057099-A2 | METHOD OF SCALE INHIBITION | Thermphos Trading GmbH (CH) | 2009-05-13 | — | — | EP | claimed |
| EP-2054423-A1 | ALPHA-AMINO ACID PHOSPHONIC ACID COMPOUNDS, METHOD OF PREPARATION AND USE THEREOF | Thermphos Trading GmbH (CH) | 2009-05-06 | — | — | EP | claimed |
| WO-2008017339-A1 | α-AMINO ACID PHOSPHONIC ACID COMPOUNDS, METHOD OF PREPARATION AND USE THEREOF | THERMPHOS TRADING GMBH (CH) | 2008-02-14 | — | — | WO | claimed |
| WO-2008017338-A2 | METHOD OF SCALE INHIBITION | THERMPHOS TRADING GMBH (CH) | 2008-02-14 | — | — | WO | claimed |
| EP-2534296-A1 | METHOD FOR PULP BLEACHING | Dequest AG (CH) | 2012-12-19 | — | — | EP | disclosed |
| WO-2011098599-A1 | METHOD FOR PULP BLEACHING | DEQUEST AG (CH) | 2011-08-18 | — | — | WO | disclosed |
| EP-2057099-A2 | METHOD OF SCALE INHIBITION | Thermphos Trading GmbH (CH) | 2009-05-13 | — | — | EP | disclosed |
| EP-2054423-A1 | ALPHA-AMINO ACID PHOSPHONIC ACID COMPOUNDS, METHOD OF PREPARATION AND USE THEREOF | Thermphos Trading GmbH (CH) | 2009-05-06 | — | — | EP | disclosed |
| WO-2008017339-A1 | α-AMINO ACID PHOSPHONIC ACID COMPOUNDS, METHOD OF PREPARATION AND USE THEREOF | THERMPHOS TRADING GMBH (CH) | 2008-02-14 | — | — | WO | disclosed |
| WO-2008017338-A2 | METHOD OF SCALE INHIBITION | THERMPHOS TRADING GMBH (CH) | 2008-02-14 | — | — | WO | disclosed |
| US-6825191-B2 | ANTICOAGULANT | AJINOMOTO CO., INC. (JP) | 2004-11-30 | — | — | US | disclosed |
| US-5817603-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1998-10-06 | — | — | US | disclosed |
| US-5719141-A | HYPOTENSIVE AGENTS | NOVARTIS CORPORATION (US) | 1998-02-17 | — | — | US | disclosed |
| EP-0702004-A2 | 2,9-diamino- and 2-amino-8-carbamoyl-4-hydroxy-alkanoic acid amid derivatives | CIBA-GEIGY AG (CH) | 1996-03-20 | — | — | EP | disclosed |
| EP-0637298-A1 | SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM | BASF Aktiengesellschaft (DE) | 1995-02-08 | — | — | EP | disclosed |
| WO-1993022280-A1 | SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM | BASF AKTIENGESELLSCHAFT (DE) | 1993-11-11 | — | — | WO | disclosed |
| EP-0078462-B1 | 1,2,4,6-THIATRIAZINE-1,1 DIOXIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTI-GROWTH AGENTS FOR UNWANTED PLANTS | BASF Aktiengesellschaft (DE) | 1986-01-15 | — | — | EP | disclosed |
| US-4472191-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1984-09-18 | — | — | US | disclosed |
| EP-0078462-A1 | 1,2,4,6-Thiatriazine-1,1 dioxides, process for their preparation and their use as anti-growth agents for unwanted plants | BASF Aktiengesellschaft (DE) | 1983-05-11 | — | — | EP | disclosed |