⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13374204 | 0.94 | — | — | |
| SCHEMBL37811 | 0.91 | CYP1A2 (0.32) | — | |
| Bromide SCHEMBL8028723 | 0.89 | DNM1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL15330133 | 0.89 | DNM1 (0.35) | — | |
| SCHEMBL20136510 | 0.89 | CYP1A2 (0.31) | — | |
| SCHEMBL4435105 | 0.88 | LMNA (0.34) | — | |
| SCHEMBL15022964 | 0.88 | — | — | |
| SCHEMBL6579071 | 0.88 | — | — | |
| SCHEMBL12794893 | 0.88 | DNM1 (0.32) | — | |
| Ethylene SCHEMBL28805811 | 0.87 | CYP1A2 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-100398193-C | Packings for liquid chromatography, process for preparing and usage | DAISO CO LTD (JP) | 2008-07-02 | — | — | CN | disclosed |
| CN-1523349-A | Packings for liquid chromatography, process for preparing and usage | 大曹株式会社 | 2004-08-25 | — | — | CN | disclosed |
| EP-1392460-A1 | HYDROGENFLUORIDES OF AMINOSILANOLS AND THEIR USE | ASHLAND INC. (US) | 2004-03-03 | — | — | EP | disclosed |
| US-6664310-B2 | Foundry binder | ASHLAND INC. | 2003-12-16 | — | — | US | disclosed |
| EP-1360156-A1 | EDGE TREATMENTS FOR COATED SUBSTRATES | Cardinal CG Company (US) | 2003-11-12 | — | — | EP | disclosed |
| US-6632856-B2 | A no-bake foundry binder system comprising: (a) polyether polyol component comprising, (1) a polyether polyol, (2) a fluorinated acid (3) an aminoalkoxysilane, (b) a polyisocyanate component, (C) a liquid tertiary amine catalyst | ASK Chemicals LLC | 2003-10-14 | — | — | US | disclosed |
| US-6602931-B2 | Polyurethane-forming binders | ASHLAND INC. | 2003-08-05 | — | — | US | disclosed |
| US-20030042000-A1 | Polyurethane-forming binders | ASK Chemicals LLC | 2003-03-06 | — | — | US | disclosed |
| US-20030037904-A1 | A no-bake foundry binder system comprising: (a) polyether polyol component comprising, (1) a polyether polyol, (2) a fluorinated acid (3) an aminoalkoxysilane, (b) a polyisocyanate component, (C) a liquid tertiary amine catalyst | ASK Chemicals LLC | 2003-02-27 | — | — | US | disclosed |
| WO-2003009954-A1 | POLYURETHANE-FORMING BINDERS | ASHLAND INC. (US) | 2003-02-06 | — | — | WO | disclosed |
| US-20030004224-A1 | Hydrogenfluorides of aminosilanols and their use | ASK Chemicals LLC | 2003-01-02 | — | — | US | disclosed |
| WO-2002090016-A1 | HYDROGENFLUORIDES OF AMINOSILANOLS AND THEIR USE | ASHLAND INC. (US) | 2002-11-14 | — | — | WO | disclosed |
| WO-2002062716-A1 | EDGE TREATMENTS FOR COATED SUBSTRATES | CARDINAL CG COMPANY (US) | 2002-08-15 | — | — | WO | disclosed |
| US-6013372-A | SELF-CLEANING, WEAR RESISTANT COATING | TOTO, LTD. (JP) | 2000-01-11 | — | — | US | disclosed |