⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12521070 | 0.88 | — | — | |
| SCHEMBL3809774 | 0.84 | — | — | |
| SCHEMBL1446243 | 0.80 | — | — | |
| SCHEMBL5603642 | 0.72 | — | — | |
| SCHEMBL11577630 | 0.72 | — | — | |
| SCHEMBL3692402 | 0.72 | — | — | |
| SCHEMBL3886059 | 0.72 | — | — | |
| SCHEMBL5832051 | 0.72 | — | — | |
| SCHEMBL3602257 | 0.70 | — | — | |
| SCHEMBL13825502 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1453789-A2 | N,N'-SUBSTITUTED-1,3-DIAMINO-2-HYDROXYPROPANE DERIVATIVES | Elan Pharmaceuticals, Inc. (US) | 2004-09-08 | — | — | EP | claimed |
| WO-2003040096-A2 | N, N'-SUBSTITUTED-1,3-DIAMINO-2-HYDROXYPROPANE DERIVATIVES | ELAN PHARMACEUTICALS, INC. (US) | 2003-05-15 | — | — | WO | claimed |
| CN-117269395-A | Construction method of qi fingerprint of agilawood and fingerprint thereof | 中国中医科学院中药研究所 | 2023-12-22 | — | — | CN | disclosed |
| CN-111454229-B | Dihydronaphthoisoxazole derivative and application thereof in antitumor drugs | 徐瑛 | 2022-07-19 | — | — | CN | disclosed |
| US-8652827-B2 | Radiosynthesis as an alternative energy utilization process in melanized organisms and uses thereof | ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) | 2014-02-18 | — | — | US | disclosed |
| EP-2645443-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT | Idemitsu Kosan Co., Ltd. (JP) | 2013-10-02 | — | — | EP | disclosed |
| CN-101775004-B | Organic molecular line and preparation method | NAT CT NANOSCIENCE NCNST CHINA | 2012-11-21 | — | — | CN | disclosed |
| US-20090328258-A1 | Radiosynthesis as an Alternative Energy Utilization Process in Melanized Organisms and Uses Thereof | ALBERT EINSTEIN COLLEGE OF MEDICINE | 2009-12-31 | — | — | US | disclosed |
| WO-2007117453-A2 | RADIOSYNTHESIS AS AN ALTERNATIVE ENERGY UTILIZATION PROCESS IN MELANIZED ORGANISMS AND USES THEREOF | ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) | 2007-10-18 | — | — | WO | disclosed |
| EP-0297804-B1 | SILVER HALIDE PHOTOGRAPHIC LIGHT-SENSITIVE MATERIAL | KONICA CORPORATION (JP) | 1993-08-18 | — | — | EP | disclosed |
| EP-0297804-A2 | Silver halide photographic light-sensitive material | KONICA CORPORATION (JP) | 1989-01-04 | — | — | EP | disclosed |