⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10449034 | 0.90 | — | — | |
| SCHEMBL9889286 | 0.68 | — | — | |
| SCHEMBL10017954 | 0.67 | — | — | |
| SCHEMBL7569925 | 0.67 | — | — | |
| SCHEMBL39635 | 0.67 | — | — | |
| SCHEMBL27741471 | 0.67 | TSHR (0.42) | — | |
| SCHEMBL2744144 | 0.65 | — | — | |
| Ethylene Glycol SCHEMBL9492826 | 0.65 | ALDH1A1 (0.41) | — | |
| SCHEMBL27741470 | 0.65 | ALDH1A1 (0.60) | — | |
| SCHEMBL11569436 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1168822-C | Immobile bacillus and method for resolving and preparing chiral cyclopentenylone using said bacillus | 华东理工大学 | 2004-09-29 | — | — | CN | claimed |
| CN-1408848-A | Immobile bacillus and method for resolving and preparing chiral cyclopentenylone using said bacillus | UNIV HUADONG SCI & ENG (CN) | 2003-04-09 | — | — | CN | claimed |
| EP-0009644-B1 | POLYPHOSPHAZENE COPOLYMERS CONTAINING ACETYLENIC SUBSTITUENTS AND PROCESS FOR PREPARING SAME | THE FIRESTONE TIRE & RUBBER COMPANY (US) | 1982-11-03 | — | — | EP | claimed |
| US-11819531-B2 | Multifunctional zwitterionic polymer conjugates | KODIAK SCIENCES INC. (US) | 2023-11-21 | — | — | US | disclosed |
| US-20230277616-A9 | MULTIFUNCTIONAL ZWITTERIONIC POLYMER CONJUGATES | KODIAK SCIENCES INC. | 2023-09-07 | — | — | US | disclosed |
| US-20200289554-A1 | BIOORTHOGONAL COMPOUNDS COMPRISING A PROPARGYL GROUP FOR TREATING CANCER | THE UNIVERSITY COURT OF THE UNIVERSITY OF EDINBURGH (GB) | 2020-09-17 | — | — | US | disclosed |
| EP-3458463-A1 | BIOORTHOGONAL COMPOUNDS COMPRISING A PROPARGYL GROUP FOR TREATING CANCER | The University Court Of The University of Edinburgh (GB) | 2019-03-27 | — | — | EP | disclosed |
| WO-2017199028-A1 | BIOORTHOGONAL COMPOUNDS COMPRISING A PROPARGYL GROUP FOR TREATING CANCER | THE UNIVERSITY COURT OF THE UNIVERSITY OF EDINBURGH (GB) | 2017-11-23 | — | — | WO | disclosed |
| WO-2016164797-A1 | ACTIVATABLE CRISPR/CAS9 FOR SPATIAL AND TEMPORAL CONTROL OF GENOME EDITING | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2016-10-13 | — | — | WO | disclosed |
| US-20160287715-A1 | MULTIFUNCTIONAL ZWITTERIONIC POLYMER CONJUGATES | KODIAK SCIENCES INC (US) | 2016-10-06 | — | — | US | disclosed |
| EP-2442809-B1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMA (US) | 2016-08-31 | — | — | EP | disclosed |
| CN-1168822-C | Immobile bacillus and method for resolving and preparing chiral cyclopentenylone using said bacillus | 华东理工大学 | 2004-09-29 | — | — | CN | disclosed |
| CN-1408848-A | Immobile bacillus and method for resolving and preparing chiral cyclopentenylone using said bacillus | UNIV HUADONG SCI & ENG (CN) | 2003-04-09 | — | — | CN | disclosed |
| US-4101387-A | SULFONATED POLYETHYLENIMINE BRIGHTENER | OXY METAL INDUSTRIES CORPORATION (US) | 1978-07-18 | — | — | US | disclosed |