⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2288282 | 0.97 | ADH1B (0.52) | — | |
| SCHEMBL2283532 | 0.97 | ADH1B (0.52) | — | |
| SCHEMBL2281691 | 0.97 | ADH1B (0.52) | — | |
| SCHEMBL2285298 | 0.97 | ADH1B (0.52) | — | |
| SCHEMBL2282753 | 0.97 | ADH1B (0.52) | — | |
| SCHEMBL2285775 | 0.97 | ADH1B (0.52) | — | |
| SCHEMBL2278628 | 0.95 | — | — | |
| SCHEMBL1766882 | 0.83 | — | — | |
| SCHEMBL13692972 | 0.80 | — | — | |
| SCHEMBL1241873 | 0.80 | TSHR (0.46) | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7994273-B2 | Photoactive materials | ROLIC AG (CH) | 2011-08-09 | — | — | US | claimed |
| US-7750185-B2 | Photoactive materials | ROLIC AG (CH) | 2010-07-06 | — | — | US | claimed |
| CN-100551902-C | light active material | ROLIC AG (CH) | 2009-10-21 | — | — | CN | claimed |
| US-20050288480-A1 | Liquid crystals adjustment layers containing diamine compound; polyamic acid or polyimides; crosslinked | ROLIC AG (CH) | 2005-12-29 | — | — | US | claimed |
| CN-1671648-A | photoactive material | ROLIC AG (CH) | 2005-09-21 | — | — | CN | claimed |
| EP-1525182-A1 | PHOTOACTIVE MATERIALS | Rolic AG (CH) | 2005-04-27 | — | — | EP | claimed |
| WO-2004013086-A1 | PHOTOACTIVE MATERIALS | ROLIC AG (CH) | 2004-02-12 | — | — | WO | claimed |
| EP-1386910-A1 | Photoactive materials | Rolic AG (CH) | 2004-02-04 | — | — | EP | claimed |
| WO-2016196994-A9 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2017-03-02 | — | — | WO | disclosed |
| US-8436132-B2 | Photoactive materials | ROLIC AG (CH) | 2013-05-07 | — | — | US | disclosed |
| US-20110236602-A1 | PHOTOACTIVE MATERIALS | ROLIC AG (CH) | 2011-09-29 | — | — | US | disclosed |
| US-7994273-B2 | Photoactive materials | ROLIC AG (CH) | 2011-08-09 | — | — | US | disclosed |
| US-20100272979-A1 | PHOTOACTIVE MATERIALS | ROLIC AG (CH) | 2010-10-28 | — | — | US | disclosed |
| US-7750185-B2 | Photoactive materials | ROLIC AG (CH) | 2010-07-06 | — | — | US | disclosed |
| US-20050288480-A1 | Liquid crystals adjustment layers containing diamine compound; polyamic acid or polyimides; crosslinked | ROLIC AG (CH) | 2005-12-29 | — | — | US | disclosed |
| EP-1386910-A1 | Photoactive materials | Rolic AG (CH) | 2004-02-04 | — | — | EP | disclosed |
| US-5278341-A | N-acylaminoalkyl 2-hydroxyethyl sulfides and a process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-01-11 | — | — | US | disclosed |