⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10147373 | 0.82 | CDC14B (0.36) | — | |
| SCHEMBL21391805 | 0.80 | LOXL2 (0.34) | — | |
| SCHEMBL12984565 | 0.77 | AHR (0.35) | — | |
| SCHEMBL12985178 | 0.76 | CYP1B1 (0.39) | — | |
| SCHEMBL19774396 | 0.75 | PRMT1 (0.35) | — | |
| SCHEMBL25497430 | 0.75 | KDM4E (0.33) | — | |
| SCHEMBL12983644 | 0.75 | CYP1A1 (0.36) | — | |
| SCHEMBL12241283 | 0.74 | SIGMAR1 (0.38) | — | |
| SCHEMBL10146711 | 0.72 | DYRK1A (0.33) | — | |
| SCHEMBL19774227 | 0.72 | KMT2A (0.35) | — |
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-20120138914-A1 | ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME | IDEMITSU KOSAN CO., LTD. (JP) | 2012-06-07 | — | — | US | disclosed |
| WO-2010137285-A1 | ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME | 出光興産株式会社 (JP) | 2010-12-02 | — | — | WO | disclosed |