⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1133410 | 0.65 | — | — | |
| SCHEMBL8751772 | 0.60 | — | — | |
| SCHEMBL1609054 | 0.58 | — | — | |
| SCHEMBL6725094 | 0.58 | — | — | |
| SCHEMBL24192307 | 0.57 | TSHR (0.31) | — | |
| SCHEMBL26778 | 0.57 | — | — | |
| SCHEMBL1670 | 0.57 | — | — | |
| SCHEMBL754334 | 0.57 | TDP1 (0.31) | — | |
| SCHEMBL668141 | 0.57 | — | — | |
| SCHEMBL9397770 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2287141-B1 | METHOD FOR PRODUCING UNSATURATED ORGANIC COMPOUND | SUMITOMO CHEMICAL CO (JP) | 2015-10-21 | — | — | EP | disclosed |
| EP-2568953-B1 | TRIAZINES AS REACTION ACCELERATORS | MERCK PATENT GMBH (DE) | 2014-05-14 | — | — | EP | disclosed |
| EP-2568953-A2 | TRIAZINES AS REACTION ACCELERATORS | Merck Patent GmbH (DE) | 2013-03-20 | — | — | EP | disclosed |
| US-20130058879-A1 | TRIAZINES AS REACTION ACCELERATORS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2013-03-07 | — | — | US | disclosed |
| US-8237002-B2 | Method for producing unsaturated organic compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-08-07 | — | — | US | disclosed |
| WO-2011141111-A2 | TRIAZINES AS REACTION ACCELERATORS | MERCK PATENT GMBH (DE) | 2011-11-17 | — | — | WO | disclosed |
| US-20110092505-A1 | ORGANIC COMPOUNDS | NOVARTIS AG (CH) | 2011-04-21 | — | — | US | disclosed |
| US-20110046380-A1 | METHOD FOR PRODUCING UNSATURATED ORGANIC COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-02-24 | — | — | US | disclosed |
| EP-2287141-A1 | METHOD FOR PRODUCING UNSATURATED ORGANIC COMPOUND | Sumitomo Chemical Company, Limited (JP) | 2011-02-23 | — | — | EP | disclosed |