⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29985512 | 0.97 | GABRR1 (0.50) | — | |
| SCHEMBL188004 | 0.97 | — | — | |
| SCHEMBL791884 | 0.97 | — | — | |
| SCHEMBL11031932 | 0.97 | GABRR1 (0.50) | — | |
| SCHEMBL61073 | 0.97 | — | — | |
| SCHEMBL17631226 | 0.94 | — | — | |
| SCHEMBL17630443 | 0.94 | — | — | |
| SCHEMBL17630445 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL27343451 | 0.94 | — | — | |
| SCHEMBL28177763 | 0.94 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102167892-B | Polylactic acid-based resin composition and molded article of polylactic acid-based resin | FUJI XEROX CORP. (JP) | 2014-10-08 | — | — | CN | disclosed |
| US-8809576-B2 | Method for producing a free acid from the salt thereof | EVONIK DEGUSSA GMBH (DE) | 2014-08-19 | — | — | US | disclosed |
| US-8258221-B2 | Polylactic acid-based resin composition and molded article of polylactic acid-based resin | FUJI XEROX CO., LTD. (JP) | 2012-09-04 | — | — | US | disclosed |
| CN-102272086-A | Method for producing a free acid from the salt thereof | — | 2011-12-07 | — | — | CN | disclosed |
| US-20110257429-A1 | METHOD FOR PRODUCING A FREE ACID FROM THE SALT THEREOF | EVONIK DEGUSSA GMBH (DE) | 2011-10-20 | — | — | US | disclosed |
| CN-102167892-A | Polylactic acid-based resin composition and molded article of polylactic acid-based resin | FUJI XEROX CO LTD | 2011-08-31 | — | — | CN | disclosed |
| US-20110207865-A1 | POLYLACTIC ACID-BASED RESIN COMPOSITION AND MOLDED ARTICLE OF POLYLACTIC ACID-BASED RESIN | FUJI XEROX CO., LTD. (JP) | 2011-08-25 | — | — | US | disclosed |
| EP-1357172-A2 | Oil-soluble imine-acid reaction products as asphaltene dispersants in crude oil | ROHM AND HAAS COMPANY (US) | 2003-10-29 | — | — | EP | disclosed |