⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12231859 | 0.86 | HDAC3 (0.42) | — | |
| SCHEMBL13998028 | 0.86 | HDAC3 (0.46) | — | |
| SCHEMBL38654455 | 0.85 | ALDH1A1 (0.42) | — | |
| SCHEMBL12642842 | 0.83 | PAOX (0.53) | — | |
| SCHEMBL4760493 | 0.82 | — | — | |
| SCHEMBL928881 | 0.82 | — | — | |
| SCHEMBL636785 | 0.81 | — | — | |
| SCHEMBL8436063 | 0.80 | — | — | |
| SCHEMBL14198853 | 0.80 | SLC6A5 (0.49) | — | |
| SCHEMBL13886236 | 0.80 | DNM1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1973575-B1 | BIOCOMPATIBLE FLUORESCENT METAL OXIDE NANOPARTICLES | VISEN MEDICAL INC (US) | 2019-07-24 | — | — | EP | disclosed |
| WO-2016019340-A1 | POLYOXAZOLINE ANTIBODY DRUG CONJUGATES | SERINA THERAPEUTICS, INC. (US) | 2016-02-04 | — | — | WO | disclosed |
| WO-2011072627-A2 | DENDRITIC HIGH-MOLECULAR-WEIGHT POLYMER DRUG CARRIERS AND THEIR CONJUGATES WITH DRUGS ESPECIALLY FOR TREATMENT OF SOLID TUMOURS | USTAV MAKROMOLEKULARNI CHEMIE AV CR, V.V.I. (CZ) | 2011-06-23 | — | — | WO | disclosed |
| US-6004531-A | LIGANDS FOR RADIOPHARMACEUTICALS; CAPABLE OF CHELATING RADIOMETAL SPECIES AND OF BEING BOUND TO BIOLOGICAL TARGETING MOLECULES | NYCOMED AMERSHAM PLC (GB) | 1999-12-21 | — | — | US | disclosed |
| US-5932707-A | Thioether-containing metal chelating compounds | NYCOMED AMERSHAM PLC (GB) | 1999-08-03 | — | — | US | disclosed |
| WO-1994022816-A1 | METAL CHELATING COMPOUNDS | AMERSHAM INTERNATIONAL PLC (GB) | 1994-10-13 | — | — | WO | disclosed |
| EP-0618191-A1 | Metal chelating compounds | AMERSHAM INTERNATIONAL plc (GB) | 1994-10-05 | — | — | EP | disclosed |