⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1585575 | 0.93 | JAK2 (0.31) | — | |
| SCHEMBL1258428 | 0.89 | NPC1 (0.33) | — | |
| SCHEMBL2275575 | 0.85 | PSMB5 (0.32) | — | |
| SCHEMBL3166128 | 0.83 | JAK2 (0.33) | — | |
| SCHEMBL1584751 | 0.80 | NPC1 (0.33) | — | |
| SCHEMBL2270492 | 0.77 | ALDH1A1 (0.34) | — | |
| SCHEMBL2101945 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL6432630 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL1142921 | 0.73 | — | — | |
| SCHEMBL296847 | 0.72 | JAK2 (0.34) | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6407153-B1 | Silica-containing rubber compositions | BAYER INC. (CA) | 2002-06-18 | — | — | US | claimed |
| EP-1021484-A1 | ELASTOMERIC COMPOSITIONS AND PROCESS FOR PRODUCTION THEREOF | Bayer Inc. (CA) | 2000-07-26 | — | — | EP | claimed |
| WO-1999015583-A1 | ELASTOMERIC COMPOSITIONS AND PROCESS FOR PRODUCTION THEREOF | BAYER INC. (CA) | 1999-04-01 | — | — | WO | claimed |
| EP-2220156-A1 | HYDROPHOBIC MODIFICATION OF MINERAL FILLERS AND MIXED POLYMER SYSTEMS | Pacific Polymers Pty Ltd (AU) | 2010-08-25 | — | — | EP | disclosed |
| WO-2009059382-A1 | HYDROPHOBIC MODIFICATION OF MINERAL FILLERS AND MIXED POLYMER SYSTEMS | PACIFIC POLYMERS PTY LTD (AU) | 2009-05-14 | — | — | WO | disclosed |
| EP-1131381-B1 | PROCESS FOR HYDROPHOBICIZING PARTICLES, AND THEIR USE IN POLYMER DISPERSIONS | BAYER INC (CA) | 2002-09-18 | — | — | EP | disclosed |
| US-6420456-B1 | ACID SALTS OF AMINES AND SILANES WITH HYDROLYSIS | BAYER INC. (CA) | 2002-07-16 | — | — | US | disclosed |
| US-6407153-B1 | Silica-containing rubber compositions | BAYER INC. (CA) | 2002-06-18 | — | — | US | disclosed |
| EP-1155077-A1 | PROCESS FOR TREATING PARTICLES, AND THEIR USE IN DISPERSIONS | Bayer Inc. (CA) | 2001-11-21 | — | — | EP | disclosed |
| EP-1131381-A1 | PROCESS FOR HYDROPHOBICIZING PARTICLES, AND THEIR USE IN POLYMER DISPERSIONS | Bayer Inc. (CA) | 2001-09-12 | — | — | EP | disclosed |
| EP-1021484-A1 | ELASTOMERIC COMPOSITIONS AND PROCESS FOR PRODUCTION THEREOF | Bayer Inc. (CA) | 2000-07-26 | — | — | EP | disclosed |
| WO-2000031180-A1 | PROCESS FOR HYDROPHOBICIZING PARTICLES, AND THEIR USE IN POLYMER DISPERSIONS | BAYER INC. (CA) | 2000-06-02 | — | — | WO | disclosed |
| WO-2000031175-A1 | PROCESS FOR TREATING PARTICLES, AND THEIR USE IN DISPERSIONS | BAYER INC. (CA) | 2000-06-02 | — | — | WO | disclosed |
| EP-0983317-A1 | PROCESS FOR HYDROPHOBICIZING PARTICLES, AND THEIR USE AS FILLERS IN POLYMER MASTERBATCHES | Bayer Inc. (CA) | 2000-03-08 | — | — | EP | disclosed |
| WO-1999015583-A1 | ELASTOMERIC COMPOSITIONS AND PROCESS FOR PRODUCTION THEREOF | BAYER INC. (CA) | 1999-04-01 | — | — | WO | disclosed |
| WO-1998053004-A1 | PROCESS FOR HYDROPHOBICIZING PARTICLES, AND THEIR USE AS FILLERS IN POLYMER MASTERBATCHES | BAYER INC. (CA) | 1998-11-26 | — | — | WO | disclosed |