⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19845428 | 0.98 | KDM4E (0.30) | — | |
| SCHEMBL19845695 | 0.96 | — | — | |
| SCHEMBL19845755 | 0.96 | PTGER4 (0.31) | — | |
| SCHEMBL18385460 | 0.95 | KDM4E (0.31) | — | |
| SCHEMBL18385444 | 0.95 | KDM4E (0.31) | — | |
| SCHEMBL18385453 | 0.95 | KDM4E (0.31) | — | |
| SCHEMBL18385435 | 0.95 | KDM4E (0.31) | — | |
| SCHEMBL19845671 | 0.95 | PDK2 (0.30) | — | |
| SCHEMBL19845429 | 0.95 | PTGER4 (0.31) | — | |
| SCHEMBL19845427 | 0.95 | PDE10A (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180037574-A1 | COMPOUND, COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO., LTD. (JP) | 2018-02-08 | — | — | US | disclosed |
| US-20180037574-A1 | COMPOUND, COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO., LTD. (JP) | 2018-02-08 | — | — | US | disclosed |