⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17750058 | 0.76 | OPRM1 (0.37) | — | |
| SCHEMBL17750068 | 0.74 | ZDHHC7 (0.38) | — | |
| SCHEMBL2389527 | 0.74 | ZDHHC7 (0.38) | — | |
| SCHEMBL17750051 | 0.74 | ZDHHC7 (0.38) | — | |
| SCHEMBL9617144 | 0.74 | — | — | |
| SCHEMBL7288552 | 0.73 | — | — | |
| SCHEMBL29980358 | 0.73 | CHRM2 (0.30) | — | |
| SCHEMBL22817582 | 0.72 | — | — | |
| SCHEMBL28340684 | 0.70 | — | — | |
| SCHEMBL1963969 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1385905-A1 | PRODUCT IN SUBDIVIDED FORM FOR PREPARING CROSSLINKABLE ELASTOMERIC COMPOSITIONS | PIRELLI PNEUMATICI S.p.A. (IT) | 2004-02-04 | — | — | EP | disclosed |
| WO-2002083783-A1 | PRODUCT IN SUBDIVIDED FORM FOR PREPARING CROSSLINKABLE ELASTOMERIC COMPOSITIONS | PIRELLI PNEUMATICI S.P.A. (IT) | 2002-10-24 | — | — | WO | disclosed |