⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5948736 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL5948565 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL2511758 | 0.76 | — | — | |
| SCHEMBL6445950 | 0.68 | ALDH1A1 (0.36) | — | |
| SCHEMBL21115362 | 0.63 | ALDH1A1 (0.36) | — | |
| SCHEMBL720718 | 0.62 | NPC1 (0.41) | — | |
| SCHEMBL4791698 | 0.61 | TUBB4A (0.44) | — | |
| SCHEMBL24311360 | 0.60 | TUBB4A (0.48) | — | |
| SCHEMBL6455046 | 0.60 | — | — | |
| SCHEMBL17916171 | 0.58 | ALDH1A1 (0.39) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1053263-B1 | CATALYST SYSTEM | BASELL POLYOLEFINE GMBH (DE) | 2003-10-01 | — | — | EP | claimed |
| US-6949614-B1 | Catalyst system | BASELL POLYOLEFINE GMBH (DE) | 2005-09-27 | — | — | US | disclosed |
| EP-1272532-B1 | SALINE CHEMICAL COMPOSITION, METHOD FOR PRODUCING THE SAME AND THE USE THEREOF IN CATALYST SYSTEMS FOR PRODUCING POLYOLEFINS | BASELL POLYOLEFINE GMBH (DE) | 2005-05-04 | — | — | EP | disclosed |
| EP-1054914-B1 | ZWITTERIONIC, NEUTRAL TRANSITION METAL COMPOUND | BASELL POLYOLEFINE GMBH (DE) | 2004-03-03 | — | — | EP | disclosed |
| EP-1175262-B1 | CATALYST SYSTEM | BASELL POLYOLEFINE GMBH (DE) | 2004-02-18 | — | — | EP | disclosed |
| EP-1290002-B1 | CHEMICAL PRODUCTS SUITED FOR USE AS CO-CATALYSTS, METHOD FOR THE PREPARATION THEREOF AND THEIR USE IN CATALYST SYSTEMS FOR PRODUCING POLYOLEFINS | BASELL POLYOLEFINE GMBH (DE) | 2004-01-21 | — | — | EP | disclosed |