⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10822282 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL2393252 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL28834416 | 0.74 | HSD17B10 (0.41) | — | |
| SCHEMBL16571551 | 0.72 | — | — | |
| Sulfuric Acid SCHEMBL28785882 | 0.72 | ACP1 (0.37) | — | |
| SCHEMBL11498362 | 0.72 | — | — | |
| SCHEMBL18471675 | 0.71 | ALDH1A1 (0.48) | — | |
| SCHEMBL2199674 | 0.71 | MAPT (0.55) | — | |
| SCHEMBL4299916 | 0.71 | ALDH1A1 (0.46) | — | |
| Aminothiazole SCHEMBL1241596 | 0.70 | ALDH1A1 (0.75) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8445509-B2 | Fused heterocyclic derivatives and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-05-21 | — | — | US | disclosed |
| US-8304557-B2 | Fused heterocycle derivatives and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-11-06 | — | — | US | disclosed |
| US-20110046169-A1 | FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-02-24 | — | — | US | disclosed |
| EP-2162445-A1 | HETEROBICYCLIC COMPOUNDS AS KINASE INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2010-03-17 | — | — | EP | disclosed |
| WO-2009136663-A1 | FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-11-12 | — | — | WO | disclosed |
| US-20090163488-A1 | FUSED HETEROCYCLE DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-06-25 | — | — | US | disclosed |
| WO-2008150015-A1 | HETEROBICYCLIC COMPOUNDS AS KINASE INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-12-11 | — | — | WO | disclosed |
| US-5891614-A | FORMING HALOGEN COMPOSITION GAP FACES AT TIME OF NUCLEATION TO PRODUCE TABULAR GRAINS | FUJI PHOTO FILM CO., LTD. (JP) | 1999-04-06 | — | — | US | disclosed |
| US-5780209-A | Processing of photographic silver halide photosensitive material | FUJI PHOTO FILM CO., LTD. (JP) | 1998-07-14 | — | — | US | disclosed |
| US-5582962-A | COLLOID LAYERS COMPRISING A DISPERSE DYE PARTICLES | KONICA CORPORATION (JP) | 1996-12-10 | — | — | US | disclosed |
| EP-0679935-A2 | Silver halide photographic light-sensitive material and the processing method thereof | KONICA CORPORATION (JP) | 1995-11-02 | — | — | EP | disclosed |
| US-4681837-A | IMPROVED COLOR REPRODUCTIBILITY | FUJI PHOTO FILM CO., LTD. (JP) | 1987-07-21 | — | — | US | disclosed |