⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2801654 | 0.90 | KCNK9 (0.32) | — | |
| Hydrochloric Acid SCHEMBL812258 | 0.89 | KCNK9 (0.32) | — | |
| SCHEMBL6226723 | 0.83 | — | — | |
| SCHEMBL4427085 | 0.82 | ACHE (0.34) | — | |
| Hydrochloric Acid SCHEMBL811664 | 0.82 | — | — | |
| SCHEMBL2803241 | 0.81 | ALDH1A1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL812467 | 0.80 | NPC1 (0.31) | — | |
| SCHEMBL2861724 | 0.80 | NPC1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL851746 | 0.80 | NPC1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL812867 | 0.80 | — | — |
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-1419184-A1 | PROCESS FOR THE POLYMERIZATION OF ETHYLENE AND INTERPOLYMERS THEREOF | EASTMAN CHEMICAL COMPANY (US) | 2004-05-19 | — | — | EP | disclosed |
| EP-1417241-A1 | PROCESS FOR THE POLYMERIZATION OF ETHYLENE AND INTERPOLYMERS THEREOF | EASTMAN CHEMICAL COMPANY (US) | 2004-05-12 | — | — | EP | disclosed |
| WO-2003010211-A1 | PROCESS FOR THE POLYMERIZATION OF ETHYLENE AND INTERPOLYMERS THEREOF | EASTMAN CHEMICAL COMPANY (US) | 2003-02-06 | — | — | WO | disclosed |
| WO-2003010212-A1 | PROCESS FOR THE POLYMERIZATION OF ETHYLENE AND INTERPOLYMERS THEREOF | EASTMAN CHEMICAL COMPANY (US) | 2003-02-06 | — | — | WO | disclosed |
| EP-0187893-A2 | Peroxide-curable brominated or iodinated fluoroelastomer composition containing an N,N,N',N'-tetrasubstituted 1,8-diaminonaphthalene | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1986-07-23 | — | — | EP | disclosed |