⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12441830 | 0.79 | S100B (0.47) | — | |
| SCHEMBL19417387 | 0.78 | NPC1 (0.38) | — | |
| SCHEMBL861925 | 0.77 | MAPT (0.57) | — | |
| SCHEMBL8964884 | 0.77 | MAPT (0.57) | — | |
| SCHEMBL3194959 | 0.77 | HTR3E (0.54) | — | |
| SCHEMBL18434711 | 0.75 | POLB (0.50) | — | |
| SCHEMBL28557524 | 0.75 | TSHR (0.39) | — | |
| SCHEMBL5144313 | 0.74 | — | — | |
| SCHEMBL30511829 | 0.72 | — | — | |
| SCHEMBL13219275 | 0.72 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020038482-A1 | Use of liquid dyestuff preparations for dyeing wood | BAYER AKTIENGESELLSCHAFT (DE) | 2002-04-04 | — | — | US | claimed |
| US-20150191493-A1 | NEW PROCESS FOR PREPARING ARYLBORANES BY ARYLATION OF ORGANOBORON COMPOUNDS | Universite de Bordeaux (FR) | 2015-07-09 | — | — | US | disclosed |
| EP-2684887-B1 | New process for preparing arylboranes by arylation of organoboron compounds | UNIV BORDEAUX (FR) | 2015-06-17 | — | — | EP | disclosed |
| EP-2311837-B1 | Azaindoles useful as inhibitors of jak and other protein kinases | VERTEX PHARMA (US) | 2014-05-21 | — | — | EP | disclosed |
| WO-2014009169-A1 | NEW PROCESS FOR PREPARING ARYLBORANES BY ARYLATION OF ORGANOBORON COMPOUNDS | UNIVERSITE DE BORDEAUX 1 (FR) | 2014-01-16 | — | — | WO | disclosed |
| EP-2684887-A1 | New process for preparing arylboranes by arylation of organoboron compounds | UNIVERSITE DE BORDEAUX I (FR) | 2014-01-15 | — | — | EP | disclosed |
| US-7157205-B2 | Intermediate layer composition for multilayer resist process, pattern-forming process using the same, and laminate | FUJI PHOTO FILM CO., LTD. (JP) | 2007-01-02 | — | — | US | disclosed |
| US-20020038482-A1 | Use of liquid dyestuff preparations for dyeing wood | BAYER AKTIENGESELLSCHAFT (DE) | 2002-04-04 | — | — | US | disclosed |
| EP-0317859-B1 | AZO DYES CONTAINING POLYETHYLENIMINE | BASF Aktiengesellschaft (DE) | 1991-11-27 | — | — | EP | disclosed |
| US-4962190-A | PRINTING, DYEING CELLULOSE CONTAINING MATERIAL | BASF AKTIENGESELLSCHAFT (DE) | 1990-10-09 | — | — | US | disclosed |
| EP-0317859-A2 | Azo dyes containing polyethylenimine | BASF Aktiengesellschaft (DE) | 1989-05-31 | — | — | EP | disclosed |