⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22199808 | 0.87 | L3MBTL1 (0.31) | — | |
| SCHEMBL22199782 | 0.85 | RXFP1 (0.32) | — | |
| SCHEMBL22199803 | 0.84 | FLT3 (0.31) | — | |
| SCHEMBL22199864 | 0.83 | — | — | |
| SCHEMBL22200034 | 0.82 | NPC1 (0.33) | — | |
| SCHEMBL22199871 | 0.82 | — | — | |
| SCHEMBL22199934 | 0.81 | TSHR (0.33) | — | |
| SCHEMBL21942052 | 0.81 | — | — | |
| SCHEMBL22200033 | 0.81 | HSD17B10 (0.38) | — | |
| SCHEMBL16582318 | 0.81 | HSD17B10 (0.40) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200216392-A1 | A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) | 2020-07-09 | — | — | US | disclosed |
| US-20160263257-A1 | CROMOLYN DERIVATIVES AND RELATED METHODS OF IMAGING AND TREATMENT | THE GENERAL HOSPITAL CORPORATION | 2016-09-15 | — | — | US | disclosed |