⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7173395 | 0.83 | MEN1 (0.31) | — | |
| SCHEMBL20573035 | 0.83 | — | — | |
| SCHEMBL17274422 | 0.82 | HTR6 (0.38) | — | |
| SCHEMBL6541969 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL29060000 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL27661593 | 0.80 | — | — | |
| SCHEMBL26134555 | 0.77 | ALDH1A1 (0.31) | — | |
| SCHEMBL7072480 | 0.76 | ABCB11 (0.37) | — | |
| SCHEMBL10965062 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL27745239 | 0.73 | ALDH1A1 (0.33) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102307938-A | Polyurethane foam composition containing flame retardant, preparation method thereof, flame-retardant composition and polyurethane foam prepared from flame-retardant composition | ICL IP AMERICA INC | 2012-01-04 | — | — | CN | disclosed |
| EP-0726288-A1 | Carboxylic acid modified polyethylene membranes | CITY OF HOPE (US) | 1996-08-14 | — | — | EP | disclosed |
| US-5306781-A | Activation accomplished by reaction with a carbodiimide; useful in the C-terminal sequencing of a peptide | CITY OF HOPE (US) | 1994-04-26 | — | — | US | disclosed |
| US-5254475-A | Coupling to form a peptidylhydantoin derivative; cleaving | CITY OF HOPE (US) | 1993-10-19 | — | — | US | disclosed |
| EP-0495939-A4 | SEQUENTIAL C-TERMINAL DEGRADATION OF PEPTIDES AND PROTEINS | — | 1992-11-25 | — | — | EP | disclosed |
| EP-0495939-A1 | SEQUENTIAL C-TERMINAL DEGRADATION OF PEPTIDES AND PROTEINS. | HOPE CITY (US) | 1992-07-29 | — | — | EP | disclosed |
| WO-1992003737-A1 | SEQUENTIAL C-TERMINAL DEGRADATION OF PEPTIDES AND PROTEINS | CITY OF HOPE (US) | 1992-03-05 | — | — | WO | disclosed |