⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7669150 | 0.60 | ALDH1A1 (0.34) | — | |
| SCHEMBL9423413 | 0.55 | — | — | |
| SCHEMBL615573 | 0.52 | MEN1 (0.31) | — | |
| SCHEMBL3668765 | 0.52 | — | — | |
| SCHEMBL497924 | 0.50 | — | — | |
| SCHEMBL7873488 | 0.50 | ALOX15 (0.30) | — | |
| SCHEMBL9812290 | 0.50 | ALOX15 (0.30) | — | |
| Methane SCHEMBL1176537 | 0.50 | ALOX15 (0.30) | — | |
| SCHEMBL57168 | 0.46 | ALDH1A1 (0.47) | — | |
| SCHEMBL29165732 | 0.43 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6500510-B1 | TRANSITION METAL COMPLEXES IN PHOTOCHROMIC DEVICES; STABLE, LONG TERM DATA STORAGE | MOLECULAR STORAGE TECHNOLOGIES, INC. | 2002-12-31 | — | — | US | claimed |
| WO-2001048751-A9 | MOLECULAR LEVEL OPTICAL INFORMATION STORAGE DEVICES | MOLECULAR STORAGE TECHNOLOGIES (US) | 2002-08-01 | — | — | WO | claimed |
| WO-2001048751-A2 | MOLECULAR LEVEL OPTICAL INFORMATION STORAGE DEVICES | MOLECULAR STORAGE TECHNOLOGIES, INC. (US) | 2001-07-05 | — | — | WO | claimed |
| US-6500510-B1 | TRANSITION METAL COMPLEXES IN PHOTOCHROMIC DEVICES; STABLE, LONG TERM DATA STORAGE | MOLECULAR STORAGE TECHNOLOGIES, INC. | 2002-12-31 | — | — | US | disclosed |
| WO-2001048751-A9 | MOLECULAR LEVEL OPTICAL INFORMATION STORAGE DEVICES | MOLECULAR STORAGE TECHNOLOGIES (US) | 2002-08-01 | — | — | WO | disclosed |
| WO-2001048751-A2 | MOLECULAR LEVEL OPTICAL INFORMATION STORAGE DEVICES | MOLECULAR STORAGE TECHNOLOGIES, INC. (US) | 2001-07-05 | — | — | WO | disclosed |