⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8566623 | 0.86 | — | — | |
| SCHEMBL6068446 | 0.79 | — | — | |
| SCHEMBL28376827 | 0.77 | — | — | |
| SCHEMBL20439663 | 0.75 | — | — | |
| SCHEMBL11902985 | 0.71 | MAPT (0.33) | — | |
| SCHEMBL24514891 | 0.68 | — | — | |
| SCHEMBL7548678 | 0.68 | NAMPT (0.31) | — | |
| SCHEMBL11502520 | 0.67 | MAPT (0.41) | — | |
| SCHEMBL149920 | 0.65 | — | — | |
| SCHEMBL9613600 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20190224214-A1 | HUMAN GHRELIN O-ACYLTRANSFERASE INHIBITORS | SYRACUSE UNIVERSITY (US) | 2019-07-25 | — | — | US | disclosed |
| WO-2018035079-A1 | HUMAN GHRELIN O-ACYL TRANSFERASE INHIBITORS | HOUGLAND JAMES L (US) | 2018-02-22 | — | — | WO | disclosed |
| US-5194650-A | Chemical intermediates which can be hydrolyzed to form arylcyclohexadionethiocarboxylic S-ester as bioregulators | BASF AKTIENGESELLSCHAFT (DE) | 1993-03-16 | — | — | US | disclosed |
| US-5130453-A | Multistage reaction of acylcyclohexadione, reaction with hydroxylamine derivative and mercaptan | BASF AKTIENGESELLSCHAFT (DE) | 1992-07-14 | — | — | US | disclosed |
| US-5085689-A | Preemergence and postemergence treatment | BASF AKTIENGESELLSCHAFT (DE) | 1992-02-04 | — | — | US | disclosed |