⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14157807 | 0.71 | CA12 (0.32) | — | |
| SCHEMBL14198227 | 0.70 | NOS3 (0.30) | — | |
| SCHEMBL13772908 | 0.67 | — | — | |
| SCHEMBL7760539 | 0.65 | — | — | |
| SCHEMBL9229414 | 0.65 | — | — | |
| SCHEMBL1627082 | 0.65 | — | — | |
| SCHEMBL1627232 | 0.65 | — | — | |
| Butyrolactone SCHEMBL25327385 | 0.64 | CA1 (0.56) | — | |
| SCHEMBL21295443 | 0.63 | — | — | |
| Butyrolactone SCHEMBL7650673 | 0.63 | CA1 (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220267300-A1 | SULFONAMIDE DERIVATIVES AND USES THEREOF | NodThera Limited (GB) | 2022-08-25 | — | — | US | disclosed |
| CN-1204175-C | Color three-dimensional storage material for optical information storage and preparation method thereof | TECHNICAL INST PHYSICS & CHEMISTRY CAS (CN) | 2005-06-01 | — | — | CN | disclosed |
| CN-1456591-A | Color three-dimensional storage material for optical information storage and preparation method thereof | PHYSICAL AND CHEMICAL TECHNOLO (CN) | 2003-11-19 | — | — | CN | disclosed |
| CN-1088086-C | Photochromic material sensitive to visible and infrared light and its preparation and application | INST OF PHOTOGRAPHIC CHEMISTRY (CN) | 2002-07-24 | — | — | CN | disclosed |
| CN-1158882-A | Photochromic material sensitive to visible and infrared light and its preparation and application | PHOTOSENSITIVE CHEMISTRY INST (CN) | 1997-09-10 | — | — | CN | disclosed |