⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14794464 | 0.85 | — | — | |
| SCHEMBL2146054 | 0.67 | — | — | |
| SCHEMBL14790869 | 0.67 | — | — | |
| SCHEMBL16503640 | 0.67 | — | — | |
| SCHEMBL1445023 | 0.62 | — | — | |
| SCHEMBL12904483 | 0.55 | — | — | |
| SCHEMBL3413343 | 0.55 | CDC25A (0.37) | — | |
| SCHEMBL5590100 | 0.53 | CDC25A (0.32) | — | |
| SCHEMBL12566336 | 0.53 | — | — | |
| SCHEMBL1299783 | 0.52 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106827754-A | Manufacture method of layered product and application thereof | 东京应化工业株式会社 | 2017-06-13 | — | — | CN | disclosed |
| US-8975235-B2 | Lysophosphatidic acid receptor antagonists | INTERMUNE, INC. (US) | 2015-03-10 | — | — | US | disclosed |
| US-20140213538-A1 | LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | INTERMUNE, INC. | 2014-07-31 | — | — | US | disclosed |
| US-20140200215-A1 | LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | INTERMUNE, INC. | 2014-07-17 | — | — | US | disclosed |
| US-20130072449-A1 | LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | INTERMUNE, INC. (US) | 2013-03-21 | — | — | US | disclosed |