⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7672001 | 0.88 | HCAR2 (0.50) | — | |
| SCHEMBL3622266 | 0.80 | HCAR2 (0.54) | — | |
| SCHEMBL20109324 | 0.80 | HCAR2 (0.43) | — | |
| SCHEMBL6688562 | 0.77 | SOAT1 (0.54) | — | |
| SCHEMBL14882679 | 0.77 | HCAR2 (0.41) | — | |
| SCHEMBL20109327 | 0.77 | HCAR2 (0.45) | — | |
| SCHEMBL1440 | 0.76 | — | — | |
| SCHEMBL4667392 | 0.76 | — | — | |
| SCHEMBL1441 | 0.76 | — | — | |
| SCHEMBL1439 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180118770-A1 | N-Heterocyclic Phosphines | THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS | 2018-05-03 | — | — | US | disclosed |
| US-8093274-B2 | Inhibitors of protein prenyltransferases | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2012-01-10 | — | — | US | disclosed |
| US-20100063114-A1 | INHIBITORS OF PROTEIN PRENYLTRANSFERASES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2010-03-11 | — | — | US | disclosed |
| WO-2010014054-A1 | INHIBITORS OF PROTEIN PRENYLTRANSFERASES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2010-02-04 | — | — | WO | disclosed |
| EP-2007383-A2 | INHIBITORS OF PROTEIN PRENYLTRANSFERASES | The Regents of the University of California (US) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007111948-A2 | INHIBITORS OF PROTEIN PRENYLTRANSFERASES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2007-10-04 | — | — | WO | disclosed |
| US-4000327-A | BERRY FRUIT FOODSTUFFS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-12-28 | — | — | US | disclosed |
| US-3984579-A | Novel flavoring compositions and products containing isomer mixtures containing high proportions of 2-methyl-cis-3-pentenoic acid | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-10-05 | — | — | US | disclosed |
| US-3931293-A | Processes for producing cis alkyl-2-methyl-3-pentenoates and isomer mixtures containing high proportions of cis alkyl-2-methyl-3-pentenoates | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-01-06 | — | — | US | disclosed |