⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4038976 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL4035866 | 0.69 | — | — | |
| SCHEMBL153452 | 0.69 | — | — | |
| SCHEMBL6433417 | 0.67 | SLC22A2 (0.30) | — | |
| SCHEMBL6437756 | 0.67 | SLC22A2 (0.30) | — | |
| SCHEMBL3644683 | 0.66 | SLC22A2 (0.39) | — | |
| SCHEMBL2937582 | 0.66 | RET (0.37) | — | |
| SCHEMBL1130808 | 0.64 | — | — | |
| SCHEMBL62066 | 0.64 | — | — | |
| SCHEMBL8857282 | 0.64 | GPR3 (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009149906-A2 | PREPARATION OF SILOXY-BRIDGED METALLOCENES | BASELL POLYOLEFINE GMBH (DE) | 2009-12-17 | — | — | WO | disclosed |
| US-7544825-B1 | Preparation of siloxy-bridged metallocenes | BASELL POLYOLEFINE GMBH (DE) | 2009-06-09 | — | — | US | disclosed |