⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3261752 | 0.82 | — | — | |
| SCHEMBL8985403 | 0.81 | GLO1 (0.41) | — | |
| SCHEMBL481575 | 0.81 | MAPT (0.40) | — | |
| SCHEMBL1083275 | 0.80 | — | — | |
| SCHEMBL1201121 | 0.79 | TDP1 (0.38) | — | |
| SCHEMBL1635822 | 0.79 | TDP1 (0.38) | — | |
| SCHEMBL45577 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL210851 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL10984210 | 0.74 | — | — | |
| SCHEMBL8616866 | 0.74 | ALDH1A1 (0.35) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2720039-B1 | AGENT FOR IMPROVING CANCER CELL ADHESIVENESS | HITACHI CHEMICAL CO LTD (JP) | 2017-07-26 | — | — | EP | disclosed |
| US-20170137548-A1 | POLYMER COMPOUND FOR MEDICAL USE AND COMPOSITION AND DEVICE USING SAME | NATIONAL UNIVERSITY CORPORATION YAMAGATA UNIVERSIT Y (JP) | 2017-05-18 | — | — | US | disclosed |
| EP-3124507-A1 | POLYMER COMPOUND FOR MEDICAL USE AND COMPOSITION AND DEVICE USING SAME | National University Corporation Yamagata University (JP) | 2017-02-01 | — | — | EP | disclosed |
| US-9372136-B2 | Agent for improving cancer cell adhesiveness | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2016-06-21 | — | — | US | disclosed |
| US-20140178890-A1 | AGENT FOR IMPROVING CANCER CELL ADHESIVENESS | YAMAGATA UNIVERSITY (JP) | 2014-06-26 | — | — | US | disclosed |
| EP-2720039-A1 | AGENT FOR IMPROVING CANCER CELL ADHESIVENESS | Hitachi Chemical Company, Ltd. (JP) | 2014-04-16 | — | — | EP | disclosed |
| US-20130123104-A1 | Adjuvant Compositions, Agricultural Pesticide Compositions, and Methods for Making and Using Such Compositions | RHODIA OPERATIONS (FR) | 2013-05-16 | — | — | US | disclosed |