⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1782003 | 0.87 | OAT (0.33) | — | |
| SCHEMBL10778292 | 0.82 | — | — | |
| SCHEMBL20436531 | 0.78 | CYP4F2 (0.40) | — | |
| SCHEMBL11682073 | 0.77 | — | — | |
| SCHEMBL10851617 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL5729206 | 0.72 | CHRNA1 (0.35) | — | |
| SCHEMBL13989191 | 0.72 | ALDH1A1 (0.43) | — | |
| SCHEMBL11429168 | 0.71 | — | — | |
| SCHEMBL10777579 | 0.70 | OAT (0.37) | — | |
| SCHEMBL13677475 | 0.70 | CYP19A1 (0.40) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8632792-B2 | Cooling sensation agent composition and sensory stimulation agent composition | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2014-01-21 | — | — | US | disclosed |
| US-20110117147-A1 | COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2011-05-19 | — | — | US | disclosed |
| WO-2009123355-A2 | COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2009-10-08 | — | — | WO | disclosed |
| US-7432058-B2 | Methods of labeling nucleic acids with energy transfer dyes | APPLERA CORPORATION (US) | 2008-10-07 | — | — | US | disclosed |
| US-20070212709-A1 | Non-nucleosidic linker linking xanthene donor to 4,7-dichlororhodamine acceptor; | APPLERA CORPORATION (US) | 2007-09-13 | — | — | US | disclosed |
| US-7169939-B2 | Energy transfer dyes with enhanced fluorescence | APPLERA CORPORATION (US) | 2007-01-30 | — | — | US | disclosed |