⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9083583 | 0.80 | ABCC4 (0.45) | — | |
| SCHEMBL26553902 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL9620929 | 0.78 | ALDH1A1 (0.39) | — | |
| SCHEMBL1283388 | 0.75 | NPC1 (0.36) | — | |
| SCHEMBL776640 | 0.75 | NPC1 (0.36) | — | |
| SCHEMBL14987781 | 0.74 | LMNA (0.38) | — | |
| SCHEMBL14987786 | 0.74 | TSHR (0.52) | — | |
| SCHEMBL2135110 | 0.73 | NPC1 (0.35) | — | |
| SCHEMBL2136773 | 0.73 | NPC1 (0.35) | — | |
| SCHEMBL3181236 | 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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100132135-A1 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | HUNTSMAN INTERNATIONAL LLC (US) | 2010-06-03 | — | — | US | claimed |
| EP-1902100-A2 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | Huntsman Advanced Materials (Switzerland) GmbH (CH) | 2008-03-26 | — | — | EP | claimed |
| WO-2007006653-A2 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (DE) | 2007-01-18 | — | — | WO | claimed |
| EP-0313513-B1 | REACTIVE DYES, THEIR PREPARATION AND THEIR USE | CIBA-GEIGY AG (CH) | 1992-06-17 | — | — | EP | claimed |
| CN-101218306-B | Reactive dyes, a process for their preparation and their use | HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) | 2011-12-21 | — | — | CN | disclosed |
| US-20100132135-A1 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | HUNTSMAN INTERNATIONAL LLC (US) | 2010-06-03 | — | — | US | disclosed |
| US-20100132135-A1 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | HUNTSMAN INTERNATIONAL LLC (US) | 2010-06-03 | — | — | US | disclosed |
| CN-101218306-A | Reactive dyes, a process for their preparation and their use | HUNTSMAN ADV MAT SWITZERLAND (CH) | 2008-07-09 | — | — | CN | disclosed |
| EP-1902100-A2 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | Huntsman Advanced Materials (Switzerland) GmbH (CH) | 2008-03-26 | — | — | EP | disclosed |
| EP-1902100-A2 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | Huntsman Advanced Materials (Switzerland) GmbH (CH) | 2008-03-26 | — | — | EP | disclosed |
| WO-2007006653-A3 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | HUNTSMAN ADV MAT SWITZERLAND (CH) | 2007-09-07 | — | — | WO | disclosed |
| WO-2007006653-A2 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (DE) | 2007-01-18 | — | — | WO | disclosed |
| WO-2007006653-A2 | REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (DE) | 2007-01-18 | — | — | WO | disclosed |
| EP-0313513-B1 | REACTIVE DYES, THEIR PREPARATION AND THEIR USE | CIBA-GEIGY AG (CH) | 1992-06-17 | — | — | EP | disclosed |
| US-4801694-A | Triazinyl reactive dyestuffs in which triazinyl group is further substituted with a beta-chloroethylsulfonyl- or vinylsulfonylbutyrylamino moiety | CIBA-GEIGY CORPORATION (US) | 1989-01-31 | — | — | US | disclosed |