⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6423248 | 0.86 | PPARG (0.42) | — | |
| SCHEMBL1685033 | 0.75 | — | — | |
| Adipic Acid SCHEMBL28021567 | 0.75 | LMNA (0.58) | — | |
| SCHEMBL10958630 | 0.74 | LMNA (0.35) | — | |
| SCHEMBL27678989 | 0.73 | LMNA (0.33) | — | |
| SCHEMBL2805983 | 0.72 | — | — | |
| SCHEMBL16308845 | 0.71 | LMNA (0.40) | — | |
| SCHEMBL294122 | 0.71 | — | — | |
| SCHEMBL8760590 | 0.70 | — | — | |
| SCHEMBL7194953 | 0.70 | GPR84 (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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105566192-B | Positively charged water-soluble prodrugs of prostaglandins and related compounds with fast skin penetration rate | 于崇曦 | 2019-01-22 | — | — | CN | disclosed |
| US-7927613-B2 | Pharmaceutical co-crystal compositions | UNIVERSITY OF SOUTH FLORIDA (US) | 2011-04-19 | — | — | US | disclosed |
| US-7790905-B2 | Pharmaceutical propylene glycol solvate compositions | MCNEIL-PPC, INC. (US) | 2010-09-07 | — | — | US | disclosed |
| US-5248788-A | Process for preparing allenic prostanoic acid derivatives | SYNTEX (U.S.A.) INC. (US) | 1993-09-28 | — | — | US | disclosed |
| EP-0373612-A2 | Process for preparing allenic prostanoic acid derivatives | SYNTEX (U.S.A.) INC. (US) | 1990-06-20 | — | — | EP | disclosed |
| US-4916238-A | Process for preparing allenic prostanoic acid derivatives | SYNTEX (U.S.A.) INC. (US) | 1990-04-10 | — | — | US | disclosed |