⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10711783 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL15031087 | 0.77 | — | — | |
| SCHEMBL6900169 | 0.76 | — | — | |
| SCHEMBL10996651 | 0.75 | — | — | |
| SCHEMBL1938740 | 0.75 | — | — | |
| SCHEMBL12616548 | 0.74 | — | — | |
| SCHEMBL604334 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL28470584 | 0.72 | — | — | |
| SCHEMBL29006352 | 0.72 | CDK1 (0.31) | — | |
| SCHEMBL69039 | 0.72 | — | — |
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-106115811-A | A kind of industrial sewage treating agent and preparation method | 含山县科宇环境工程有限公司 | 2016-11-16 | — | — | CN | claimed |
| CN-105968493-A | Antimicrobial breakage-proof packaging bag and preparation method thereof | 苏州倍力特物流设备有限公司 | 2016-09-28 | — | — | CN | claimed |
| CN-105256547-A | Novel antibacterial and flame-retardant finishing agent and preparation method thereof | FU SHUZHEN | 2016-01-20 | — | — | CN | claimed |
| CN-106115811-A | A kind of industrial sewage treating agent and preparation method | 含山县科宇环境工程有限公司 | 2016-11-16 | — | — | CN | disclosed |
| CN-105968493-A | Antimicrobial breakage-proof packaging bag and preparation method thereof | 苏州倍力特物流设备有限公司 | 2016-09-28 | — | — | CN | disclosed |
| CN-105256547-A | Novel antibacterial and flame-retardant finishing agent and preparation method thereof | FU SHUZHEN | 2016-01-20 | — | — | CN | disclosed |