⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL126369 | 0.95 | CRHBP (0.33) | — | |
| SCHEMBL126377 | 0.94 | ALDH1A1 (0.39) | — | |
| SCHEMBL10353959 | 0.92 | ABCG2 (0.35) | — | |
| SCHEMBL125668 | 0.91 | ALDH1A1 (0.30) | — | |
| SCHEMBL2757086 | 0.91 | — | — | |
| SCHEMBL126378 | 0.91 | — | — | |
| SCHEMBL10353948 | 0.91 | KIF11 (0.40) | — | |
| SCHEMBL10010771 | 0.91 | MEN1 (0.32) | — | |
| SCHEMBL125611 | 0.91 | — | — | |
| SCHEMBL12575844 | 0.91 | PGR (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 |
|---|---|---|---|---|---|---|---|
| US-20120056165-A1 | ORGANIC LUMINESCENT MEDIUM | IDEMITSU KOSAN CO., LTD. | 2012-03-08 | — | — | US | disclosed |
| US-20120013244-A1 | ORGANIC LUMINESCENT MEDIUM | IDEMITSU KOSAN CO., LTD. | 2012-01-19 | — | — | US | disclosed |