⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6124940 | 0.85 | — | — | |
| SCHEMBL42544 | 0.76 | — | — | |
| Fluoride SCHEMBL31324810 | 0.72 | — | — | |
| SCHEMBL21787982 | 0.69 | CA14 (0.31) | — | |
| SCHEMBL9115546 | 0.67 | — | — | |
| SCHEMBL23867613 | 0.64 | — | — | |
| SCHEMBL10089100 | 0.64 | — | — | |
| SCHEMBL4884101 | 0.64 | — | — | |
| SCHEMBL21537284 | 0.64 | — | — | |
| SCHEMBL10299727 | 0.64 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018086585-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |
| US-5380625-A | N,N-substituted malondiamide couplers and aromatic primary amine color developers | FUJI PHOTO FILM CO., LTD. (JP) | 1995-01-10 | — | — | US | disclosed |
| US-5328812-A | High speed | FUJI PHOTO FILM CO., LTD. (JP) | 1994-07-12 | — | — | US | disclosed |
| US-5278034-A | Color development agent | FUJI PHOTO FILM CO., LTD. (JP) | 1994-01-11 | — | — | US | disclosed |