⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11812971 | 0.78 | ALDH1A1 (0.31) | — | |
| SCHEMBL1515547 | 0.77 | — | — | |
| SCHEMBL16280996 | 0.75 | KDM4E (0.42) | — | |
| SCHEMBL125115 | 0.75 | — | — | |
| SCHEMBL25341003 | 0.73 | — | — | |
| SCHEMBL95243 | 0.73 | — | — | |
| SCHEMBL7113973 | 0.73 | — | — | |
| SCHEMBL156638 | 0.73 | — | — | |
| SCHEMBL1133260 | 0.73 | — | — | |
| Bromide SCHEMBL8373854 | 0.73 | LMNA (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101208094-B | Pharmacokinetic improved compounds | SURFACE LOGIX, INC. (US) | 2014-10-15 | — | — | CN | disclosed |
| US-7868032-B2 | Prostamide receptor antagonists | ALLERGAN, INC. (US) | 2011-01-11 | — | — | US | disclosed |
| CN-101208094-A | Pharmacokinetic improved compounds | SURFACE LOGIX INC (US) | 2008-06-25 | — | — | CN | disclosed |
| US-20080096240-A1 | NOVEL PROSTAMIDE RECEPTOR ANTAGONISTS | WOODWARD DAVID F | 2008-04-24 | — | — | US | disclosed |