⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7571681 | 0.78 | — | — | |
| SCHEMBL5672758 | 0.73 | — | — | |
| SCHEMBL2277166 | 0.71 | — | — | |
| SCHEMBL2103371 | 0.71 | — | — | |
| SCHEMBL2271112 | 0.69 | — | — | |
| SCHEMBL5699013 | 0.69 | TSHR (0.30) | — | |
| SCHEMBL7158758 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL5672756 | 0.66 | — | — | |
| SCHEMBL7569522 | 0.65 | — | — | |
| SCHEMBL1721424 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001060932-A1 | ANTIFOULING PAINT COMPOSITION | J.C. HEMPEL'S SKIBSFARVE-FABRIK A/S (DK) | 2001-08-23 | — | — | WO | claimed |
| EP-1238980-B1 | Silyl (meth)acrylates having bulky substituent group and preparation thereof | SHINETSU CHEMICAL CO (JP) | 2006-06-14 | — | — | EP | disclosed |
| US-6498264-B2 | REACTING A CHLOROSILANE COMPOUND WITH ACRYLIC OR METHACRYLIC ACID IN THE PRESENCE OF A BASIC COMPOUND; PROTECTIVE HYDROLYSABLE COATINGS FOR SHIP BOTTOMS; NONTOXIC; POLLUTION CONTROL; KINETICS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-12-24 | — | — | US | disclosed |
| US-20020128503-A1 | Silyl (meth)acrylates having bulky substituent group and preparation thereof | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-09-12 | — | — | US | disclosed |
| EP-1238980-A1 | Silyl (meth)acrylates having bulky substituent group and preparation thereof | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-09-11 | — | — | EP | disclosed |
| WO-2001060932-A1 | ANTIFOULING PAINT COMPOSITION | J.C. HEMPEL'S SKIBSFARVE-FABRIK A/S (DK) | 2001-08-23 | — | — | WO | disclosed |
| US-5011943-A | FK-506 C10 -C24 process intermediates | MERCK FROSST CANADA, INC. (CA) | 1991-04-30 | — | — | US | disclosed |