⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14895697 | 0.93 | — | — | |
| SCHEMBL27875431 | 0.75 | — | — | |
| SCHEMBL5698965 | 0.74 | — | — | |
| SCHEMBL28069129 | 0.74 | — | — | |
| SCHEMBL20746548 | 0.73 | THRA (0.31) | — | |
| SCHEMBL1871785 | 0.69 | — | — | |
| SCHEMBL27514606 | 0.69 | — | — | |
| SCHEMBL15188665 | 0.68 | PPM1B (0.35) | — | |
| SCHEMBL23648172 | 0.68 | — | — | |
| SCHEMBL12670017 | 0.68 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9365722-B2 | Routes to trans A,B-substituted bacteriochlorins | NORTH CAROLINA STATE UNIVERSITY (US) | 2016-06-14 | — | — | US | disclosed |
| US-9365722-B2 | Routes to trans A,B-substituted bacteriochlorins | NORTH CAROLINA STATE UNIVERSITY (US) | 2016-06-14 | — | — | US | disclosed |
| US-9365722-B2 | Routes to trans A,B-substituted bacteriochlorins | NORTH CAROLINA STATE UNIVERSITY (US) | 2016-06-14 | — | — | US | disclosed |
| US-20140221644-A1 | NEW ROUTES TO TRANS A,B-SUBSTITUTED BACTERIOCHLORINS | UNITED STATES DEPARTMENT OF ENERGY | 2014-08-07 | — | — | US | disclosed |
| US-20140221644-A1 | NEW ROUTES TO TRANS A,B-SUBSTITUTED BACTERIOCHLORINS | UNITED STATES DEPARTMENT OF ENERGY | 2014-08-07 | — | — | US | disclosed |
| US-20140221644-A1 | NEW ROUTES TO TRANS A,B-SUBSTITUTED BACTERIOCHLORINS | UNITED STATES DEPARTMENT OF ENERGY | 2014-08-07 | — | — | US | disclosed |
| WO-2013062670-A2 | NEW ROUTES TO TRANS A,B-SUBSTITUTED BACTERIOCHLORINS | NORTH CAROLINA STATE UNIVERSITY (US) | 2013-05-02 | — | — | WO | disclosed |
| WO-2013062670-A2 | NEW ROUTES TO TRANS A,B-SUBSTITUTED BACTERIOCHLORINS | NORTH CAROLINA STATE UNIVERSITY (US) | 2013-05-02 | — | — | WO | disclosed |