Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL8112548 | 0.82 | OPRL1 (0.36) | — | |
| SCHEMBL14544260 | 0.82 | MAOB (0.42) | MAOBMAOA | |
| SCHEMBL31650647 | 0.80 | KDM1A (0.32) | — | |
| SCHEMBL31649854 | 0.80 | KDM1A (0.32) | — | |
| SCHEMBL5479147 | 0.79 | MAOB (0.38) | MAOBMAOA | |
| SCHEMBL4345940 | 0.79 | MAOB (0.38) | MAOBMAOA | |
| SCHEMBL22317792 | 0.78 | KDM1A (0.49) | — | |
| SCHEMBL18682845 | 0.78 | OPRM1 (0.49) | — | |
| SCHEMBL11133978 | 0.77 | HTR2C (0.36) | MAOBMAOA | |
| SCHEMBL4809590 | 0.77 | SLC6A2 (0.34) | MAOBMAOA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7390772-B2 | 1-phenyl-spiro[2.5]octane-1-carbonitrile analogues their use in fragrance formulations | INTERNATIONAL FLAVOR & FRAGRANCES INC. (US) | 2008-06-24 | — | — | US | disclosed |
| US-20070270328-A1 | 1-PHENYL-SPIRO[2.5]OCTANE-1-CARBONITRILE ANALOGUES THEIR USE IN FRAGRANCE FORMULATIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2007-11-22 | — | — | US | disclosed |
| EP-1857437-A1 | 1-Phenyl-spiro[2.5]octane-1-carbonitrile analogues and their use in fragrance formulations | INTERNATIONAL FLAVORS & FRAGRANCES, INC. (US) | 2007-11-21 | — | — | EP | disclosed |