⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27679549 | 0.97 | — | — | |
| SCHEMBL28286607 | 0.75 | — | — | |
| SCHEMBL27679569 | 0.71 | LMNA (0.32) | — | |
| SCHEMBL3872482 | 0.65 | — | — | |
| SCHEMBL3883067 | 0.65 | — | — | |
| SCHEMBL440206 | 0.63 | TSHR (0.38) | — | |
| SCHEMBL339538 | 0.63 | — | — | |
| SCHEMBL3967923 | 0.60 | TSHR (0.35) | — | |
| Hydrochloric Acid SCHEMBL20500178 | 0.60 | TSHR (0.35) | — | |
| Bromide SCHEMBL20500191 | 0.60 | TSHR (0.35) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104364277-B | Process for controlling the polymer composition of an ethylene copolymer obtained from a catalyst system comprising a transition metal catalyst component and a ziegler catalyst component | 巴塞尔聚烯烃股份有限公司 | 2017-02-22 | — | — | CN | disclosed |