⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6683262 | 1.00 | — | — | |
| SCHEMBL6819424 | 0.83 | — | — | |
| SCHEMBL3357035 | 0.83 | — | — | |
| SCHEMBL12898630 | 0.81 | — | — | |
| SCHEMBL3356851 | 0.79 | ALOX15 (0.48) | — | |
| SCHEMBL15773068 | 0.79 | — | — | |
| SCHEMBL8191642 | 0.79 | ATM (0.50) | — | |
| SCHEMBL15641312 | 0.79 | ATM (0.50) | — | |
| SCHEMBL1543791 | 0.78 | NPSR1 (0.58) | — | |
| SCHEMBL8579928 | 0.77 | NPSR1 (0.63) | — |
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 9 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 |
| WO-2004013207-A1 | POLYMETHYLENE AMINE, METHOD FOR THE PRODUCTION AND USE THEREOF | BASF AKTIENGESELLSCHAFT (DE) | 2004-02-12 | — | — | WO | disclosed |
| US-4500528-A | HYPOTENSIVE AGENTS | USV PHARMACEUTICAL CORPORATION (US) | 1985-02-19 | — | — | US | disclosed |
| US-3952008-A | DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC | BAYER AKTIENGESELLSCHAFT (DT) | 1976-04-20 | — | — | US | disclosed |