⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7105090 | 0.78 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL24072865 | 0.78 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL1557617 | 0.78 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL7070405 | 0.77 | TSHR (0.42) | — | |
| Methyl 2-Methylbutanoate SCHEMBL108113 | 0.76 | — | — | |
| SCHEMBL2909414 | 0.76 | — | — | |
| SCHEMBL295130 | 0.76 | — | — | |
| SCHEMBL86348 | 0.76 | — | — | |
| Methyl 2-Methylbutanoate SCHEMBL1869834 | 0.76 | CA1 (0.46) | — | |
| Methyl 2-Methylbutanoate SCHEMBL283261 | 0.76 | — | — |
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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0735819-B1 | CRYPTOPHYCINS | UNIV HAWAII (US) | 2001-07-11 | — | — | EP | claimed |
| JP-H09510436-A | — | — | 1997-10-21 | — | — | JP | claimed |
| EP-0735819-A4 | NEW CRYPTOPHYCINS | UNIV HAWAII (US) | 1997-03-19 | — | — | EP | claimed |
| EP-0735819-A1 | NEW CRYPTOPHYCINS | UNIVERSITY OF HAWAII (US) | 1996-10-09 | — | — | EP | claimed |
| WO-1995017093-A1 | NEW CRYPTOPHYCINS | UNIVERSITY OF HAWAII (US) | 1995-06-29 | — | — | WO | claimed |
| EP-1124903-B1 | CATIONIC AZO-DYES | BASF AG (DE) | 2003-06-25 | — | — | EP | disclosed |
| US-6346609-B1 | DISAZO DYES OR POLYAZO DYES | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-12 | — | — | US | disclosed |
| EP-1124903-A1 | CATIONIC AZO-DYES | BASF AKTIENGESELLSCHAFT (DE) | 2001-08-22 | — | — | EP | disclosed |
| EP-0955342-B1 | Cationic azo dyes derived from aminobenzoic acid | BASF AG (DE) | 2001-07-11 | — | — | EP | disclosed |
| EP-0735819-B1 | CRYPTOPHYCINS | UNIV HAWAII (US) | 2001-07-11 | — | — | EP | disclosed |
| EP-0830136-A4 | NEW CRYPTOPHYCINS FROM SYNTHESIS | UNIV HAWAII (US) | 2001-01-24 | — | — | EP | disclosed |
| EP-0836382-A4 | NEW CRYPTOPHYCINS | UNIV HAWAII (US) | 2001-01-17 | — | — | EP | disclosed |
| EP-0836382-A1 | NEW CRYPTOPHYCINS | UNIVERSITY OF HAWAII (US) | 1998-04-22 | — | — | EP | disclosed |
| EP-0830136-A1 | NEW CRYPTOPHYCINS FROM SYNTHESIS | UNIVERSITY OF HAWAII (US) | 1998-03-25 | — | — | EP | disclosed |
| EP-0735819-A4 | NEW CRYPTOPHYCINS | UNIV HAWAII (US) | 1997-03-19 | — | — | EP | disclosed |
| WO-1996039829-A9 | NEW CRYPTOPHYCINS | — | 1997-02-20 | — | — | WO | disclosed |
| WO-1996040184-A1 | NEW CRYPTOPHYCINS FROM SYNTHESIS | UNIVERSITY OF HAWAII (US) | 1996-12-19 | — | — | WO | disclosed |
| WO-1996039829-A1 | NEW CRYPTOPHYCINS | UNIVERSITY OF HAWAII (US) | 1996-12-19 | — | — | WO | disclosed |
| EP-0735819-A1 | NEW CRYPTOPHYCINS | UNIVERSITY OF HAWAII (US) | 1996-10-09 | — | — | EP | disclosed |
| WO-1995017093-A1 | NEW CRYPTOPHYCINS | UNIVERSITY OF HAWAII (US) | 1995-06-29 | — | — | WO | disclosed |