⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1781361 | 1.00 | — | — | |
| SCHEMBL1783383 | 0.86 | TSHR (0.44) | — | |
| SCHEMBL1783382 | 0.86 | TSHR (0.44) | — | |
| SCHEMBL1782969 | 0.84 | FAAH (0.50) | — | |
| SCHEMBL1782966 | 0.84 | FAAH (0.50) | — | |
| SCHEMBL1784333 | 0.82 | FAAH (0.54) | — | |
| SCHEMBL1784335 | 0.82 | FAAH (0.54) | — | |
| SCHEMBL1783408 | 0.79 | — | — | |
| SCHEMBL1783407 | 0.79 | — | — | |
| SCHEMBL7849284 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109069378-B | Perfume mixture containing ester and ketone | 西姆莱斯股份公司 | 2022-10-11 | — | — | CN | disclosed |
| CN-103181421-B | Method for raising local flavor of animal oil | FENGYI SHANGHAI BIOTECHNOLOGY RES & DEV CT CO LTD | 2015-01-14 | — | — | CN | disclosed |
| US-8632792-B2 | Cooling sensation agent composition and sensory stimulation agent composition | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2014-01-21 | — | — | US | disclosed |
| CN-103181421-A | Method for raising local flavor of animal oil | FENGYI SHANGHAI BIOTECHNOLOGY RES & DEV CT CO LTD | 2013-07-03 | — | — | CN | 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 |