⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10102409 | 0.97 | — | — | |
| SCHEMBL10102305 | 0.92 | PDCD1 (0.31) | — | |
| SCHEMBL10102321 | 0.92 | — | — | |
| SCHEMBL15763098 | 0.91 | PDCD1 (0.31) | — | |
| SCHEMBL10102299 | 0.88 | PDCD1 (0.32) | — | |
| SCHEMBL4568620 | 0.85 | PDCD1 (0.32) | — | |
| SCHEMBL18099436 | 0.84 | MGAM (0.33) | — | |
| SCHEMBL25844438 | 0.83 | CA12 (0.31) | — | |
| SCHEMBL25844582 | 0.81 | ALKBH3 (0.33) | — | |
| SCHEMBL10267890 | 0.81 | TGFBR1 (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8308995-B2 | Chromene compound | TOKUYAMA CORPORATION (JP) | 2012-11-13 | — | — | US | disclosed |
| US-20120138876-A1 | CHROMENE COMPOUND | KASAI SOKO (JP) | 2012-06-07 | — | — | US | disclosed |
| US-8147726-B2 | Chromene compound | TOKUYAMA CORPORATION (JP) | 2012-04-03 | — | — | US | disclosed |
| US-20110062396-A1 | CHROMENE COMPOUND | TOKUYAMA CORPORATION (JP) | 2011-03-17 | — | — | US | disclosed |