⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19529462 | 0.85 | — | — | |
| SCHEMBL11877191 | 0.81 | DNM1 (0.44) | — | |
| SCHEMBL4066107 | 0.80 | — | — | |
| SCHEMBL2386598 | 0.80 | — | — | |
| SCHEMBL27296600 | 0.78 | CA12 (0.40) | — | |
| SCHEMBL4736964 | 0.78 | — | — | |
| SCHEMBL6658335 | 0.76 | — | — | |
| SCHEMBL14895229 | 0.76 | — | — | |
| SCHEMBL10432324 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL6658330 | 0.76 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113302266-B | Traction fluid | 路博润公司 | 2023-02-24 | — | — | CN | disclosed |
| CN-113302266-A | Traction fluid | 路博润公司 | 2021-08-24 | — | — | CN | disclosed |
| CN-112204119-A | Compositions, methods and uses | 因诺斯佩克有限公司 | 2021-01-08 | — | — | CN | disclosed |
| CN-105722961-B | Purposes, relevant concentrations and composition of the quaternized nitrogen compound in fuel | 巴斯夫欧洲公司 | 2019-07-12 | — | — | CN | disclosed |
| CN-109486539-A | Polycarboxylic acid based additive for fuel and lubricant | 巴斯夫欧洲公司 | 2019-03-19 | — | — | CN | disclosed |
| CN-106133007-B | Polycarboxylic acid-based additives for fuels and lubricants | 巴斯夫欧洲公司 | 2018-11-27 | — | — | CN | disclosed |
| CN-105849238-B | With purposes of the quaternized nitrogen compound of the polycarboxylic acid of epoxyalkane and alkyl substitution as the additive in fuel and lubricant | 巴斯夫欧洲公司 | 2017-08-15 | — | — | CN | disclosed |
| CN-105722961-A | USE OF SPECIFIC DERIVATIVES OF QUATERNISED NITROGEN COMPOUNDS AS ADDITIVES IN FUELS AND LUBRICANTS | 巴斯夫欧洲公司 | 2016-06-29 | — | — | CN | disclosed |
| CN-105593347-A | Fuel composition | INNOSPEC LTD | 2016-05-18 | — | — | CN | disclosed |
| WO-2010101560-A1 | BIS[(ALKYLAMINO)ALKYL]AMINES | ALBEMARLE CORPORATION (US) | 2010-09-10 | — | — | WO | disclosed |