⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL16669174 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL16668837 | 0.99 | — | — | |
| Iodide SCHEMBL16668821 | 0.99 | — | — | |
| Methyl Alcohol SCHEMBL16669124 | 0.98 | — | — | |
| Dimethylamine SCHEMBL16669018 | 0.97 | — | — | |
| Isopropyl Alcohol SCHEMBL16669072 | 0.95 | — | — | |
| Tert-Butanol SCHEMBL16669023 | 0.95 | — | — | |
| Diethylamine SCHEMBL16669132 | 0.93 | ADRB2 (0.33) | — | |
| SCHEMBL16669246 | 0.93 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL16669077 | 0.89 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3063184-B1 | ASYMMETRIC CATALYSTS FOR OLEFIN POLYMERISATION | EXXONMOBIL CHEMICAL PATENTS INC (US) | 2017-11-29 | — | — | EP | disclosed |
| EP-3063184-A1 | ASYMMETRIC POLYPROPYLENE CATALYSTS | ExxonMobil Chemical Patents Inc. (US) | 2016-09-07 | — | — | EP | disclosed |
| US-9266910-B2 | Asymmetric polypropylene catalysts | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2016-02-23 | — | — | US | disclosed |
| WO-2015065681-A1 | ASYMMETRIC POLYPROPYLENE CATALYSTS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2015-05-07 | — | — | WO | disclosed |
| US-20150119539-A1 | Asymmetric Polypropylene Catalysts | EXXONMOBIL CHEMICAL PATENTS INC. | 2015-04-30 | — | — | US | disclosed |