⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3778830 | 0.83 | — | — | |
| SCHEMBL8137858 | 0.83 | — | — | |
| SCHEMBL13387147 | 0.82 | TRPV1 (0.48) | — | |
| SCHEMBL28352610 | 0.81 | — | — | |
| SCHEMBL2835456 | 0.81 | — | — | |
| SCHEMBL23604934 | 0.81 | — | — | |
| SCHEMBL3367338 | 0.81 | — | — | |
| SCHEMBL9680375 | 0.81 | — | — | |
| SCHEMBL27392007 | 0.79 | — | — | |
| SCHEMBL3365704 | 0.79 | SPHK1 (0.95) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014107523-A2 | CHLORINE-TOLERANT POLYAMIDE DERIVATIVES FOR PREPARING BIOFOULING-RESISTANT REVERSE OSMOSIS MEMBRANES AND MEMBRANES MADE THEREFROM | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2014-07-10 | — | — | WO | disclosed |
| EP-0369271-A2 | Antistatic polyurethane-urea dispersions | THE DOW CHEMICAL COMPANY (US) | 1990-05-23 | — | — | EP | disclosed |