⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3700473 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL2233539 | 0.90 | — | — | |
| SCHEMBL6910939 | 0.89 | — | — | |
| SCHEMBL11967835 | 0.89 | — | — | |
| SCHEMBL5177617 | 0.87 | — | — | |
| SCHEMBL6904168 | 0.86 | — | — | |
| SCHEMBL5275988 | 0.86 | — | — | |
| SCHEMBL11968364 | 0.84 | GPR84 (0.30) | — | |
| SCHEMBL11967893 | 0.84 | GPR84 (0.30) | — | |
| SCHEMBL2234772 | 0.83 | BRD4 (0.32) | — |
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-10662322-B2 | Propylene polymer composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2020-05-26 | — | — | US | disclosed |
| US-20180312675-A1 | PROPYLENE POLYMER COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2018-11-01 | — | — | US | disclosed |
| US-20040260107-A1 | Organometallic transition metal compound, biscyclopentadienyl ligand system, catalyst system and preparation of polyolefins | EQUISTAR CHEMICALS, LP | 2004-12-23 | — | — | US | disclosed |