⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8370302 | 0.88 | — | — | |
| SCHEMBL28925615 | 0.82 | — | — | |
| SCHEMBL7894741 | 0.79 | — | — | |
| SCHEMBL28799355 | 0.74 | — | — | |
| Benzoquinone SCHEMBL2813316 | 0.55 | ALDH1A1 (0.67) | — | |
| Benzene SCHEMBL8162907 | 0.48 | — | — | |
| SCHEMBL9005288 | 0.47 | — | — | |
| SCHEMBL165 | 0.47 | — | — | |
| SCHEMBL29374945 | 0.45 | — | — | |
| SCHEMBL461657 | 0.42 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6391980-B1 | Activated and conjugated polystyrene substrate | AVENTIS PHARMACEUTICALS PRODUCTS, INC. | 2002-05-21 | — | — | US | disclosed |
| US-6361936-B1 | BINDING MICROORGANISMS, CELLS | AVENTIS PHARMACEUTICALS PRODUCTS, INC. | 2002-03-26 | — | — | US | disclosed |
| EP-0294059-B1 | Activated and conjugated polyaryl substrates | RHONE POULENC RORER PHARMA (US) | 1998-01-28 | — | — | EP | disclosed |
| US-5484852-A | AMINOPROTEINS WITH TYROSINE TO 3,6-DISULFATONAPHTHOL/1-/ AND IMMUNOGLOBULINS | APPLIED IMMUNE SCIENCES, INC. (US) | 1996-01-16 | — | — | US | disclosed |
| US-5241012-A | Nitrated, reduced to amine, diazotization to link with protein ; electrophilic substitution | APPLIED IMMUNE SCIENCES, INC. (US) | 1993-08-31 | — | — | US | disclosed |
| EP-0294059-A2 | Activated and conjugated polyaryl substrates | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1988-12-07 | — | — | EP | disclosed |