⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7797179 | 0.74 | — | — | |
| SCHEMBL11040011 | 0.73 | — | — | |
| SCHEMBL11040006 | 0.73 | — | — | |
| SCHEMBL1766439 | 0.71 | — | — | |
| SCHEMBL19707642 | 0.71 | — | — | |
| SCHEMBL6230018 | 0.69 | — | — | |
| SCHEMBL28771117 | 0.69 | — | — | |
| SCHEMBL28900408 | 0.69 | — | — | |
| SCHEMBL28064633 | 0.69 | — | — | |
| SCHEMBL27879372 | 0.69 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8444953-B2 | Low toxicity halogen and boron-containing tetraphenylporphyrin compounds in boron neutron capture therapy, photodynamic therapy for treatment of tumors of the brain, head and neck | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2013-05-21 | — | — | US | disclosed |
| US-20080233047-A1 | Symmetric and Asymmetric Halogen-Containing Metallocarboranylporphyrins and Uses Thereof | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2008-09-25 | — | — | US | disclosed |
| EP-0889097-B1 | PHTHALOCYANINE COMPOUNDS, PROCESS FOR PREPARING THE SAME, AND OPTICAL RECORDING MEDIUM MADE USING THE SAME | NIPPON CATALYTIC CHEM IND (JP) | 2005-06-29 | — | — | EP | disclosed |
| EP-0719258-B1 | CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS | OTSUKA PHARMA CO LTD (JP) | 2001-10-31 | — | — | EP | disclosed |
| US-5998609-A | OPTICAL RECORDING MEDIA | NIPPON SHOKUBAI CO., LTD. (JP) | 1999-12-07 | — | — | US | disclosed |
| EP-0889097-A1 | PHTHALOCYANINE COMPOUNDS, PROCESS FOR PREPARING THE SAME, AND OPTICAL RECORDING MEDIUM MADE USING THE SAME | NIPPON SHOKUBAI CO., LTD. (JP) | 1999-01-07 | — | — | EP | disclosed |
| US-5786367-A | OXYGEN SCAVENGERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-07-28 | — | — | US | disclosed |
| EP-0719258-A1 | CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1996-07-03 | — | — | EP | disclosed |
| WO-1996002508-A1 | CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1996-02-01 | — | — | WO | disclosed |
| EP-0012338-A1 | Dihydropyridazinones, process for their preparation and therapeutical agents containing them | BASF Aktiengesellschaft (DE) | 1980-06-25 | — | — | EP | disclosed |