⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8344927 | 0.79 | — | — | |
| SCHEMBL11597477 | 0.77 | — | — | |
| SCHEMBL4376109 | 0.75 | — | — | |
| SCHEMBL7071563 | 0.71 | — | — | |
| SCHEMBL12192282 | 0.71 | TAS2R38 (0.32) | — | |
| SCHEMBL99153 | 0.71 | — | — | |
| SCHEMBL15163564 | 0.71 | — | — | |
| SCHEMBL7164608 | 0.69 | — | — | |
| SCHEMBL434749 | 0.69 | — | — | |
| SCHEMBL1863499 | 0.69 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101378829-B | IPBC-containing coacervates | LANXESS DEUTSCHLAND GMBH | 2013-03-27 | — | — | CN | disclosed |
| US-8143275-B2 | Use of triazolopyrimidine derivatives as microbicides | LANXESS DEUTSCHLAND GMBH (DE) | 2012-03-27 | — | — | US | disclosed |
| US-20110098279-A1 | USE OF TRIAZOLOPYRIMIDINE DERIVATIVES AS MICROBICIDES | LANXESS DEUTSCHLAND GMBH (DE) | 2011-04-28 | — | — | US | disclosed |
| CN-101784187-A | Particulate polymers comprising biocidal active substances | LANXESS DEUTSCHLAND GMBH | 2010-07-21 | — | — | CN | disclosed |
| CN-101378829-A | IPBC-containing coacervates | LANXESS DEUTSCHLAND GMBH (DE) | 2009-03-04 | — | — | CN | disclosed |
| US-20030129081-A1 | Thiazines and thiazoles as agents for protecting materials | BAYER AKTIENGESELLSCHAFT (DE) | 2003-07-10 | — | — | US | disclosed |
| CN-1283081-A | algicide | BAYER AG (DE) | 2001-02-07 | — | — | CN | disclosed |
| CN-1242769-A | Arylthiodithiazindioxides and their use as pesticides | BAYER AG (DE) | 2000-01-26 | — | — | CN | disclosed |
| WO-1997034476-A1 | MEDICAL WASTE SOLIDIFIER AND MICROBICIDAL COMPOSITION | VIATRO, CORP. (US) | 1997-09-25 | — | — | WO | disclosed |
| EP-0297303-B1 | Fluorophores for encapsulation into liposomes | ABBOTT LAB (US) | 1995-03-15 | — | — | EP | disclosed |
| US-4970074-A | FLUORESCEIN DERIVATIVES; DRUG DELIVERY | ABBOTT LABORATORIES (US) | 1990-11-13 | — | — | US | disclosed |
| EP-0297303-A2 | Fluorophores for encapsulation into liposomes | ABBOTT LABORATORIES (US) | 1989-01-04 | — | — | EP | disclosed |