⚠ 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 | |
|---|---|---|---|---|
| Isopropylhydroxylamine SCHEMBL64261 | 0.91 | — | — | |
| Isopropylhydroxylamine SCHEMBL245852 | 0.86 | — | — | |
| Isopropylhydroxylamine SCHEMBL6118070 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL1568793 | 0.73 | — | — | |
| Oxalic Acid SCHEMBL10472230 | 0.72 | TP53 (0.39) | — | |
| Hydrochloric Acid SCHEMBL6950357 | 0.70 | — | — | |
| SCHEMBL590442 | 0.67 | — | — | |
| SCHEMBL15213035 | 0.65 | — | — | |
| Hydroxyamine SCHEMBL28640404 | 0.64 | — | — | |
| Isopropyl Alcohol SCHEMBL20338127 | 0.64 | ALDH1A1 (0.75) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2376551-B1 | INCREASED MONOMER CONVERSION IN EMULSION POLYMERIZATION | STYRON EUROPE GMBH (CH) | 2012-11-14 | — | — | EP | disclosed |
| US-20120142853-A1 | NOVEL PHENOLIC RESINS | SWEDO RAYMOND J (US) | 2012-06-07 | — | — | US | disclosed |
| EP-1751199-B1 | NOVEL PHENOLIC RESINS | ANGUS CHEMICAL (US) | 2010-11-24 | — | — | EP | disclosed |
| US-7319130-B2 | Phenolic resins | ANGUS CHEMICAL COMPANY (US) | 2008-01-15 | — | — | US | disclosed |
| US-7319131-B2 | Phenolic resins | ANGUS CHEMICAL COMPANY (US) | 2008-01-15 | — | — | US | disclosed |
| US-7317063-B2 | Phenolic resins | ANGUS CHEMICAL COMPANY (US) | 2008-01-08 | — | — | US | disclosed |
| US-20070055041-A1 | Novel phenolic resins | SWEDO RAYMOND J | 2007-03-08 | — | — | US | disclosed |
| EP-1751199-A1 | NOVEL PHENOLIC RESINS | ANGUS CHEMICAL COMPANY (US) | 2007-02-14 | — | — | EP | disclosed |
| WO-2005108453-A1 | NOVEL PHENOLIC RESINS | ANGUS CHEMICAL COMPANY (US) | 2005-11-17 | — | — | WO | disclosed |
| EP-1569975-A2 | PHENOLIC RESINS | ANGUS CHEMICAL COMPANY (US) | 2005-09-07 | — | — | EP | disclosed |
| US-20050054787-A1 | Novel phenolic resins | ANGUS CHEMICAL COMPANY | 2005-03-10 | — | — | US | disclosed |
| US-20040198926-A1 | Novel phenolic resins | ANGUS CHEMICAL COMPANY | 2004-10-07 | — | — | US | disclosed |
| US-20040116647-A1 | Novel phenolic resins | ANGUS CHEMICAL COMPANY | 2004-06-17 | — | — | US | disclosed |
| WO-2004050733-A2 | PHENOLIC RESINS | ANGUS CHEMICAL COMPANY (US) | 2004-06-17 | — | — | WO | disclosed |