⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3194331 | 0.76 | — | — | |
| SCHEMBL1145575 | 0.72 | — | — | |
| SCHEMBL5135507 | 0.71 | MMP2 (0.35) | — | |
| SCHEMBL473606 | 0.70 | CHRNB2 (0.34) | — | |
| SCHEMBL564790 | 0.70 | THRB (0.43) | — | |
| Formaldehyde SCHEMBL28646603 | 0.69 | THRB (0.42) | — | |
| SCHEMBL16993776 | 0.67 | — | — | |
| SCHEMBL515092 | 0.67 | — | — | |
| SCHEMBL660473 | 0.67 | — | — | |
| SCHEMBL14876788 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0711813-B1 | Antifouling coating composition | HITACHI CHEMICAL CO LTD (JP) | 2001-07-25 | — | — | EP | disclosed |
| US-5773508-A | BIODEGRADABLE POLYMER OF ADDITION COPOLYMERS FOR PROTECTIVE COATINGS | HITACHI CHEMICAL COMPANY, LTD. (JP) | 1998-06-30 | — | — | US | disclosed |
| EP-0711813-A2 | Coating varnish composition and antifouling coating composition | Hitachi Chemical Co., Ltd. (JP) | 1996-05-15 | — | — | EP | disclosed |