⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18740462 | 1.00 | — | — | |
| SCHEMBL2286052 | 1.00 | — | — | |
| SCHEMBL8922105 | 0.95 | ALDH1A1 (0.30) | — | |
| SCHEMBL4421790 | 0.83 | — | — | |
| SCHEMBL6024965 | 0.83 | — | — | |
| SCHEMBL4421794 | 0.83 | — | — | |
| SCHEMBL15823164 | 0.81 | — | — | |
| SCHEMBL3003480 | 0.80 | ALDH1A1 (0.38) | — | |
| SCHEMBL29885718 | 0.77 | ALDH1A1 (0.44) | — | |
| SCHEMBL29886257 | 0.77 | ALDH1A1 (0.44) | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5690857-A | LIQUID CRYSTAL ENCAPSULATED AND COATED WITH A METAL OXIDE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-11-25 | — | — | US | claimed |
| EP-0617730-B1 | THERMOCHROMIC EFFECT PIGMENT AND PROCESS FOR PRODUCING THE SAME | MERCK PATENT GMBH (DE) | 1996-02-14 | — | — | EP | claimed |
| EP-0617730-A1 | THERMOCHROMIC EFFECT PIGMENT AND PROCESS FOR PRODUCING THE SAME. | MERCK PATENT GMBH (DE) | 1994-10-05 | — | — | EP | claimed |
| WO-1993012195-A1 | THERMOCHROMIC EFFECT PIGMENT AND PROCESS FOR PRODUCING THE SAME | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1993-06-24 | — | — | WO | claimed |
| EP-0423293-B1 | DECORATIVE COMPOSITION | MERCK PATENT GmbH (DE) | 1993-04-21 | — | — | EP | claimed |
| EP-0471046-A1 | COLOURANT | MERCK PATENT GmbH (DE) | 1992-02-19 | — | — | EP | claimed |
| WO-1991013125-A2 | COLOURANT | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-09-05 | — | — | WO | claimed |
| EP-0423293-A1 | DECORATIVE COMPOSITION. | MERCK PATENT GMBH (DE) | 1991-04-24 | — | — | EP | claimed |
| WO-1990013282-A2 | DECORATIVE COMPOSITION | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-11-15 | — | — | WO | claimed |
| US-5690857-A | LIQUID CRYSTAL ENCAPSULATED AND COATED WITH A METAL OXIDE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-11-25 | — | — | US | disclosed |
| EP-0617730-B1 | THERMOCHROMIC EFFECT PIGMENT AND PROCESS FOR PRODUCING THE SAME | MERCK PATENT GMBH (DE) | 1996-02-14 | — | — | EP | disclosed |
| EP-0617730-A1 | THERMOCHROMIC EFFECT PIGMENT AND PROCESS FOR PRODUCING THE SAME. | MERCK PATENT GMBH (DE) | 1994-10-05 | — | — | EP | disclosed |
| WO-1993012195-A1 | THERMOCHROMIC EFFECT PIGMENT AND PROCESS FOR PRODUCING THE SAME | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1993-06-24 | — | — | WO | disclosed |
| EP-0423293-B1 | DECORATIVE COMPOSITION | MERCK PATENT GmbH (DE) | 1993-04-21 | — | — | EP | disclosed |
| EP-0471046-A1 | COLOURANT | MERCK PATENT GmbH (DE) | 1992-02-19 | — | — | EP | disclosed |
| WO-1991013125-A2 | COLOURANT | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-09-05 | — | — | WO | disclosed |
| EP-0423293-A1 | DECORATIVE COMPOSITION. | MERCK PATENT GMBH (DE) | 1991-04-24 | — | — | EP | disclosed |
| WO-1990013282-A2 | DECORATIVE COMPOSITION | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-11-15 | — | — | WO | disclosed |