⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3657247 | 0.82 | APP (0.35) | — | |
| SCHEMBL3664832 | 0.78 | APP (0.33) | — | |
| SCHEMBL3661620 | 0.77 | — | — | |
| SCHEMBL3662992 | 0.70 | HSP90AA1 (0.33) | — | |
| SCHEMBL3761656 | 0.68 | — | — | |
| SCHEMBL3664833 | 0.68 | — | — | |
| SCHEMBL3661618 | 0.66 | HSP90AA1 (0.32) | — | |
| SCHEMBL27494089 | 0.66 | PDCD1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL3756607 | 0.65 | — | — | |
| SCHEMBL8468224 | 0.65 | PDCD1 (0.33) | — |
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-8207281-B2 | Process for preparing transition metal compounds for olefins polymerization | BASELL POLYOLEFINE GMBH (DE) | 2012-06-26 | — | — | US | disclosed |
| US-20100311926-A1 | PROCESS FOR PREPARING TRANSITION METAL COMPOUNDS FOR OLEFINS POLYMERIZATION | BASELL POLYOLEFINE GMBH (DE) | 2010-12-09 | — | — | US | disclosed |