⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL249164 | 0.80 | — | — | |
| SCHEMBL6661696 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL9937866 | 0.78 | — | — | |
| SCHEMBL30703877 | 0.77 | — | — | |
| SCHEMBL15440677 | 0.77 | EPHX1 (0.41) | — | |
| Hydrochloric Acid SCHEMBL21647593 | 0.75 | EPHX1 (0.39) | — | |
| SCHEMBL15720631 | 0.73 | — | — | |
| SCHEMBL17206239 | 0.73 | EPHX1 (0.38) | — | |
| SCHEMBL3397473 | 0.72 | — | — | |
| SCHEMBL22699548 | 0.72 | CYP2D6 (0.45) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101065427-B | Modified open-cell foams and method for the production thereof | BASF AG | 2010-06-16 | — | — | CN | disclosed |
| CN-101065427-A | Modified open-cell foams and method for the production thereof | BASF AG (DE) | 2007-10-31 | — | — | CN | disclosed |
| CN-1221704-C | Method for the application of durable press finishes to textile components via the use of hydrophobic bleachig preparation | STERLIKE INVESTEMENT INC (US) | 2005-10-05 | — | — | CN | disclosed |
| CN-1401032-A | Method for the application of durable press finishes to textile components via the use of hydrophobic bleachig preparation | PROCTER & GAMBLE (US) | 2003-03-05 | — | — | CN | disclosed |
| US-4451620-A | Diethanolamine salt of sulphamic acid as a curing accelerator for aminoplast resins | CASSELLA AKTIENGESELLSCHAFT (DE) | 1984-05-29 | — | — | US | disclosed |