⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16415862 | 0.82 | ESR2 (0.31) | — | |
| SCHEMBL2360998 | 0.77 | — | — | |
| SCHEMBL5889192 | 0.75 | — | — | |
| SCHEMBL12656250 | 0.75 | — | — | |
| SCHEMBL10320985 | 0.75 | — | — | |
| SCHEMBL7856504 | 0.73 | — | — | |
| SCHEMBL8071462 | 0.72 | FYN (0.33) | — | |
| SCHEMBL10320188 | 0.72 | — | — | |
| SCHEMBL23183086 | 0.71 | — | — | |
| SCHEMBL10318955 | 0.71 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1238362-C | 'Pi' complex compounds | BAYER AG (DE) | 2006-01-25 | — | — | CN | disclosed |
| CN-1169792-C | Substituted vinylpyridine derivatives and medicaments containing them | ������ҩ��ʽ���� | 2004-10-06 | — | — | CN | disclosed |
| CN-1100054-C | Process for preparing HIV protease inhibitors from (2S) -4-picolyl-2-piperazine-tert-butylcarboxamide | MERCK & CO INC (US) | 2003-01-29 | — | — | CN | disclosed |
| CN-1093132-C | Metallocene compounds | BAYER AG (DE) | 2002-10-23 | — | — | CN | disclosed |
| CN-1284960-A | Pi complex compound | BAYER AG (DE) | 2001-02-21 | — | — | CN | disclosed |
| CN-1267656-A | Process for producing indene compound adapted for being as metallocene ligand | MONTELL TECHNOLOGY COMPANY BV (NL) | 2000-09-27 | — | — | CN | disclosed |
| CN-1052736-C | Process for the preparation of amorphous propylene polymers | MONTELL TECHNOLOGY COMPANY BV (NL) | 2000-05-24 | — | — | CN | disclosed |
| CN-1046727-C | HIV protease inhibitors | MERCK & CO INC (US) | 1999-11-24 | — | — | CN | disclosed |
| CN-1229410-A | Metallocene compounds | BAYER AG (DE) | 1999-09-22 | — | — | CN | disclosed |
| CN-1206407-A | Substituted vinylpyridine derivatives and medicaments containing them | SS PHARMACEUTICAL CO (JP) | 1999-01-27 | — | — | CN | disclosed |
| CN-1183779-A | Process for preparing HIV protease inhibitors from (2S) -4-picolyl-2-piperazine-tert-butylcarboxamide | MERCK & CO INC (US) | 1998-06-03 | — | — | CN | disclosed |
| CN-1147822-A | Reactor blend polypropylene, process for the preparation thereof and process for preparing metallocene ligands | MONTELL TECHNOLOGY COMPANY BV (NL) | 1997-04-16 | — | — | CN | disclosed |
| CN-1142827-A | HIV protease inhibitors | MERCK & CO INC (US) | 1997-02-12 | — | — | CN | disclosed |
| CN-1123796-A | Process for the preparation of amorphous propylene polymers | SPHERILENE SPA (IT) | 1996-06-05 | — | — | CN | disclosed |