⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10937981 | 0.78 | CA2 (0.45) | — | |
| SCHEMBL126712 | 0.77 | — | — | |
| SCHEMBL28165020 | 0.75 | — | — | |
| SCHEMBL128581 | 0.75 | — | — | |
| SCHEMBL224781 | 0.74 | — | — | |
| SCHEMBL29728562 | 0.74 | ALOX15 (0.43) | — | |
| SCHEMBL4444662 | 0.74 | ALOX15 (0.43) | — | |
| SCHEMBL9363529 | 0.72 | HTT (0.40) | — | |
| SCHEMBL25200468 | 0.72 | — | — | |
| SCHEMBL7297893 | 0.72 | — | — |
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-4619992-A | IMPROVED COLORFASTNESS | BASF AKTIENGESELLSCHAFT (DE) | 1986-10-28 | — | — | US | claimed |
| EP-0689507-A1 | INK RIBBONS CONTAINING COMPOUNDS ABSORBING IN THE IR REGION | BASF AKTIENGESELLSCHAFT (DE) | 1996-01-03 | — | — | EP | disclosed |
| WO-1994021471-A1 | INK RIBBONS CONTAINING COMPOUNDS ABSORBING IN THE IR REGION | BASF AKTIENGESELLSCHAFT (DE) | 1994-09-29 | — | — | WO | disclosed |
| EP-0169483-B1 | HETEROCYCLIC AZO DYES | BASF Aktiengesellschaft (DE) | 1989-11-15 | — | — | EP | disclosed |
| US-4619992-A | IMPROVED COLORFASTNESS | BASF AKTIENGESELLSCHAFT (DE) | 1986-10-28 | — | — | US | disclosed |
| US-4202816-A | ENOL-PIPERIDINE METAL COMPLEXES | CIBA-GEIGY CORPORATION (US) | 1980-05-13 | — | — | US | disclosed |