⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9816 | 0.88 | — | — | |
| SCHEMBL4396289 | 0.84 | SIGMAR1 (0.33) | — | |
| SCHEMBL4389342 | 0.82 | SIGMAR1 (0.41) | — | |
| SCHEMBL18282347 | 0.82 | TSHR (0.33) | — | |
| SCHEMBL10783088 | 0.80 | SIGMAR1 (0.45) | — | |
| SCHEMBL31189768 | 0.78 | — | — | |
| SCHEMBL423925 | 0.77 | — | — | |
| SCHEMBL2430959 | 0.74 | — | — | |
| SCHEMBL13298853 | 0.72 | — | — | |
| SCHEMBL8402496 | 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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019068783-A1 | BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2019-04-11 | — | — | WO | disclosed |
| EP-1882686-B1 | Pyrrolidine and piperidine derivates as NK1 antagonists | OPKO HEALTH INC (US) | 2011-08-31 | — | — | EP | disclosed |
| US-7683077-B2 | Piperidine derivative | AJINOMOTO CO., INC. (JP) | 2010-03-23 | — | — | US | disclosed |
| US-7683077-B2 | Piperidine derivative | AJINOMOTO CO., INC. (JP) | 2010-03-23 | — | — | US | disclosed |
| US-20090306376-A1 | OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME | MITSUI CHEMICALS, INC. (JP) | 2009-12-10 | — | — | US | disclosed |
| WO-2008127715-A1 | CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES | PTC THERAPEUTICS, INC. (US) | 2008-10-23 | — | — | WO | disclosed |
| WO-2005089764-A9 | CARBOLINE DERIVATIVES USEFUL IN THE INHIBITION OF ANGIOGENESIS | PTC THERAPEUTICS INC (US) | 2007-09-13 | — | — | WO | disclosed |
| US-20070054084-A1 | Optical recording medium and compound used for the same | MITSUI CHEMICALS, INC. (JP) | 2007-03-08 | — | — | US | disclosed |
| US-20070021460-A1 | Novel piperidine derivative | AJINOMOTO CO., INC. (JP) | 2007-01-25 | — | — | US | disclosed |
| US-20070021460-A1 | Novel piperidine derivative | AJINOMOTO CO., INC. (JP) | 2007-01-25 | — | — | US | disclosed |
| EP-1672626-A1 | OPTICAL RECORDING MEDIUM AND COMPOUND USED IN THE OPTICAL RECORDING MEDIUM | Mitsui Chemicals, Inc. (JP) | 2006-06-21 | — | — | EP | disclosed |
| US-5023253-A | Antitumor agents | UNIVERSITY PATENTS, INC. (US) | 1991-06-11 | — | — | US | disclosed |
| EP-0324109-A2 | 6-substituted mitomycin analogs | UNIVERSITY PATENTS, INC. (US) | 1989-07-19 | — | — | EP | disclosed |
| WO-1989005811-A1 | NEW 6-SUBSTITUTED MITOMYCIN ANALOGS | UNIVERSITY PATENTS, INC. (US) | 1989-06-29 | — | — | WO | disclosed |