⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1373025 | 0.84 | — | — | |
| SCHEMBL18890497 | 0.71 | MEN1 (0.40) | — | |
| SCHEMBL4931900 | 0.69 | MEN1 (0.36) | — | |
| SCHEMBL9429297 | 0.63 | — | — | |
| SCHEMBL709998 | 0.63 | — | — | |
| SCHEMBL4938759 | 0.61 | NOX1 (0.52) | — | |
| SCHEMBL3416420 | 0.59 | NOX1 (0.53) | — | |
| Hydrochloric Acid SCHEMBL8629495 | 0.58 | NOX1 (0.52) | — | |
| SCHEMBL4931906 | 0.58 | NOX1 (0.52) | — | |
| Hydrochloric Acid SCHEMBL27752615 | 0.58 | NOX1 (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2543981-A1 | DETECTION DEVICE | Nippon Kayaku Kabushiki Kaisha (JP) | 2013-01-09 | — | — | EP | disclosed |
| US-20120325658-A1 | DETECTION DEVICE | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2012-12-27 | — | — | US | disclosed |
| US-8268017-B2 | Method for stabilizing leuco-type colorant | ASAHI KASEI PHARMA CORPORATION (JP) | 2012-09-18 | — | — | US | disclosed |
| US-20080295259-A1 | METHOD FOR STABILIZING LEUCO-TYPE COLORANT | ASAHI KASEI PHARMA CORPORATION (JP) | 2008-12-04 | — | — | US | disclosed |