⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL27530789 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL28409967 | 0.97 | — | — | |
| Bromide SCHEMBL28417963 | 0.97 | — | — | |
| SCHEMBL13177765 | 0.79 | — | — | |
| SCHEMBL120101 | 0.75 | TSHR (0.39) | — | |
| SCHEMBL19370971 | 0.73 | — | — | |
| SCHEMBL26213405 | 0.73 | RAPGEF4 (0.39) | — | |
| SCHEMBL10411849 | 0.72 | CYP3A4 (0.37) | — | |
| SCHEMBL12955081 | 0.72 | ESR1 (0.33) | — | |
| SCHEMBL2724509 | 0.72 | CYP3A4 (0.44) | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230303514-A1 | TLR7/8 ANTAGONISTS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2023-09-28 | — | — | US | disclosed |
| CN-108864413-B | Epoxy resin composition and semiconductor device | 信越化学工业株式会社 | 2022-10-21 | — | — | CN | disclosed |
| CN-105189604-B | The production of makrolon with limited metal residue | 沙特基础全球技术有限公司 | 2018-02-02 | — | — | CN | disclosed |
| CN-105189604-A | Production of a polycarbonate with limited metal residuals | SABIC INNOVATIVE PLASTICS IP | 2015-12-23 | — | — | CN | disclosed |
| CN-102187442-A | Method for manufacturing semiconductor device and semiconductor device | SUMITOMO BAKELITE CO | 2011-09-14 | — | — | CN | disclosed |
| CN-1699382-A | Sulfonic acid amine salt and method for producing the same | KURARAY CO (JP) | 2005-11-23 | — | — | CN | disclosed |
| CN-1216059-C | Phosphonium salts, process for producing the same, use thereof, phosphine produced from the phosphonium salts and process for producing the same | KURARAY CO (JP) | 2005-08-24 | — | — | CN | disclosed |
| CN-1105118-C | Method for producing high melting-point polyolefins | BAYER AG (DE) | 2003-04-09 | — | — | CN | disclosed |
| CN-1097059-C | Method for preparing thermoplastic elastomer | BAYER AG (DE) | 2002-12-25 | — | — | CN | disclosed |
| CN-1097060-C | Method for producing elastomers | BAYER AG (DE) | 2002-12-25 | — | — | CN | disclosed |
| CN-1384106-A | Phosphonium salts, process for producing the same, use thereof, phosphine produced from the phosphonium salts and process for producing the same | KURARAY CO (JP) | 2002-12-11 | — | — | CN | disclosed |
| CN-1229415-A | Method for producing elastomers | BAYER AG (DE) | 1999-09-22 | — | — | CN | disclosed |
| CN-1229418-A | Process for preparing high-melting polyolefin | BAYER AG (DE) | 1999-09-22 | — | — | CN | disclosed |
| CN-1228790-A | Method for producing thermoplastic elastomers | BAYER AG (DE) | 1999-09-15 | — | — | CN | disclosed |
| CN-1043232-C | Catalyst composition and use of same for oligomerizing or polymerizing olefins | SHELL INT RESEARCH (NL) | 1999-05-05 | — | — | CN | disclosed |
| US-5481049-A | REACTING CONJUGATED DIENE AND WATER IN PRESENCE OF CARBON DIOXIDE, USING PALLADIUM COMPOUND AND A FREE PHOSPHINE AS CATALYSTS | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-01-02 | — | — | US | disclosed |