⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22787457 | 0.74 | — | — | |
| SCHEMBL27498105 | 0.67 | — | — | |
| SCHEMBL487087 | 0.59 | KDM4E (0.35) | — | |
| SCHEMBL22787454 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL6741838 | 0.57 | KDM4E (0.33) | — | |
| SCHEMBL11891517 | 0.56 | — | — | |
| SCHEMBL11993168 | 0.54 | — | — | |
| SCHEMBL16603058 | 0.54 | — | — | |
| SCHEMBL21182115 | 0.54 | — | — | |
| SCHEMBL18723397 | 0.54 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11832509-B2 | Organometallic compound, organic light-emitting device including the same, and diagnostic composition including the organometallic compound | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2023-11-28 | — | — | US | disclosed |
| US-20200321532-A1 | COMPOUND | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 2020-10-08 | — | — | US | disclosed |
| EP-2768611-B1 | PROCESS FOR HYDROGENATION OF NITRILE RUBBER USING CATALYST COMPOSITIONS COMPRISING A GRUBBS-HOVEYDA TYPE COMPLEX AND A TERMINAL OLEFIN | ARLANXEO DEUTSCHLAND GMBH (DE) | 2018-08-01 | — | — | EP | disclosed |