⚠ 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 | |
|---|---|---|---|---|
| D-Alanine SCHEMBL27970972 | 1.00 | — | — | |
| Alanine SCHEMBL28602339 | 1.00 | — | — | |
| Alanine SCHEMBL28244159 | 1.00 | — | — | |
| Alanine SCHEMBL7532121 | 1.00 | — | — | |
| Alanine SCHEMBL1436679 | 1.00 | — | — | |
| Alanine SCHEMBL21828377 | 1.00 | SLC7A5 (0.56) | — | |
| Alanine SCHEMBL1332110 | 0.96 | — | — | |
| D-Alanine SCHEMBL2027760 | 0.96 | SLC7A5 (0.59) | — | |
| Alanine SCHEMBL2784274 | 0.96 | — | — | |
| Alanine SCHEMBL452350 | 0.96 | SLC7A5 (0.59) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108165376-B | Detergent | 山东泰和水处理科技股份有限公司 | 2021-03-12 | — | — | CN | claimed |
| CN-108977287-A | A kind of low foam automobile cleaning agent | 江苏法瑞德专用汽车有限公司 | 2018-12-11 | — | — | CN | claimed |
| CN-107974359-A | A kind of cleaning agent prescription for being used to clean glass curtain wall | 成都凯斯恩科技有限公司 | 2018-05-01 | — | — | CN | claimed |
| CN-108165376-B | Detergent | 山东泰和水处理科技股份有限公司 | 2021-03-12 | — | — | CN | disclosed |
| CN-109022165-A | A kind of concentrated detergent powder and preparation method thereof | 张剑 | 2018-12-18 | — | — | CN | disclosed |
| CN-108441343-A | A kind of combustion-chamber deposit cleaning agent | 苏州龙腾万里化工科技有限公司 | 2018-08-24 | — | — | CN | disclosed |
| CN-108048857-A | A kind of detergent for metal surface | 微普安全科技（徐州）股份有限公司 | 2018-05-18 | — | — | CN | disclosed |
| CN-106281752-A | A kind of automobile carbon deposition scavenger specially | 梁恭喜 | 2017-01-04 | — | — | CN | disclosed |
| CN-106281754-A | A kind of air throttle of car scavenger specially | 梁恭喜 | 2017-01-04 | — | — | CN | disclosed |