⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8205641 | 0.90 | — | — | |
| SCHEMBL7905099 | 0.76 | KDM4E (0.37) | — | |
| SCHEMBL20377264 | 0.70 | — | — | |
| SCHEMBL8205643 | 0.67 | KDM4E (0.37) | — | |
| SCHEMBL7064134 | 0.60 | KDM4E (0.34) | — | |
| SCHEMBL5159548 | 0.60 | KDM4E (0.34) | — | |
| SCHEMBL5701610 | 0.59 | KDM4E (0.36) | — | |
| SCHEMBL556904 | 0.59 | KDM4E (0.36) | — | |
| SCHEMBL28222987 | 0.57 | CHRM2 (0.36) | — | |
| SCHEMBL2800949 | 0.57 | KDM4E (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0872903-B1 | Method for making hydrogen storage alloy powder and electrode comprising the alloy powder | SHINETSU CHEMICAL CO (JP) | 2001-10-04 | — | — | EP | disclosed |
| US-6277519-B1 | QUENCHING AN ALLOY MELT; COMMINUTION | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2001-08-21 | — | — | US | disclosed |
| EP-0872903-A1 | Method for making hydrogen storage alloy powder and electrode comprising the alloy powder | Shin-Etsu Chemical Co., Ltd. (JP) | 1998-10-21 | — | — | EP | disclosed |