⚠ 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 | |
|---|---|---|---|---|
| Propionitrile SCHEMBL10189197 | 0.82 | — | — | |
| SCHEMBL30978756 | 0.72 | — | — | |
| Propionitrile SCHEMBL27701221 | 0.70 | — | — | |
| Propionitrile SCHEMBL2872825 | 0.70 | — | — | |
| Propionitrile SCHEMBL15485 | 0.70 | — | — | |
| Propionitrile SCHEMBL28117218 | 0.70 | — | — | |
| Propionitrile SCHEMBL10885255 | 0.67 | — | — | |
| Propionitrile SCHEMBL6900957 | 0.67 | — | — | |
| Propionitrile SCHEMBL11133901 | 0.67 | — | — | |
| Propionitrile SCHEMBL7745947 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130274299-A1 | Cognition Enhancing Compounds and Compositions, Methods of Making, and Methods of Treating | MAPLIGHT THERAPEUTICS, INC. | 2013-10-17 | — | — | US | disclosed |
| US-20120046273-A1 | COMPOUNDS AND COMPOSITIONS FOR COGNITION-ENHANCEMENT, METHODS OF MAKING, AND METHODS OF TREATING | MITHRIDION, INC. (US) | 2012-02-23 | — | — | US | disclosed |
| US-20110263613-A1 | COMPOUNDS AND COMPOSITIONS FOR COGNITION-ENHANCEMENT, METHODS OF MAKING, AND METHODS OF TREATING | MAPLIGHT THERAPEUTICS, INC. | 2011-10-27 | — | — | US | disclosed |
| US-20090062323-A1 | DEUTERIUM-ENRICHED IRINOTECAN | PROTIA, LLC (US) | 2009-03-05 | — | — | US | disclosed |