⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3997560 | 0.98 | — | — | |
| SCHEMBL7108781 | 0.84 | — | — | |
| SCHEMBL3998655 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL8024824 | 0.76 | — | — | |
| SCHEMBL6553665 | 0.74 | — | — | |
| SCHEMBL1032918 | 0.73 | TSHR (0.32) | — | |
| Hydrochloric Acid SCHEMBL3192152 | 0.73 | — | — | |
| SCHEMBL8614491 | 0.73 | — | — | |
| SCHEMBL7032913 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL9421209 | 0.72 | — | — |
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 |
| EP-0537686-B1 | Process for preparing an olefinpolymer by using metallocenes having specially substituted indenylligands | BASELL POLYOLEFINE GMBH (DE) | 2005-01-12 | — | — | EP | disclosed |
| US-6620953-B1 | Complexing dimethylbis(2-methyl-4,5-benzoindenyl)silane with transition metal compounds such as 2,4-di-tert-butylphenoxide, zirconium monochloride, to form polymerization catalysts | BASSELL POLYOLEFINE GMBH (DE) | 2003-09-16 | — | — | US | disclosed |
| EP-1133504-B1 | METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES | BASELL POLYOLEFINE GMBH (DE) | 2003-03-12 | — | — | EP | disclosed |
| WO-2002070570-A2 | PROPYLENE POLYMERS FOR FILMS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2002-09-12 | — | — | WO | disclosed |
| EP-0537686-A1 | Process for preparing an olefinpolymer by using metallocenes having specially substituted indenylligands | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-04-21 | — | — | EP | disclosed |