⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11693327 | 1.00 | CA12 (0.91) | — | |
| Water SCHEMBL28369583 | 0.96 | — | — | |
| SCHEMBL1473809 | 0.96 | CA12 (0.92) | — | |
| Hydrochloric Acid SCHEMBL8723992 | 0.96 | KDM4E (0.85) | — | |
| Trientine SCHEMBL9635022 | 0.96 | CA12 (0.92) | — | |
| SCHEMBL5314937 | 0.95 | CA12 (1.00) | — | |
| SCHEMBL15381 | 0.95 | — | — | |
| SCHEMBL25342018 | 0.91 | CA12 (1.00) | — | |
| SCHEMBL15797 | 0.91 | CA12 (1.00) | — | |
| Trientine SCHEMBL15439 | 0.91 | CA12 (1.00) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101621126-B | Method for preparing fuel cell film pole | UNIV SHANGHAI JIAOTONG | 2011-06-08 | — | — | CN | disclosed |
| CN-101621126-A | Method for preparing fuel cell film pole | UNIV SHANGHAI JIAOTONG | 2010-01-06 | — | — | CN | disclosed |
| CN-101306385-A | Oxygen reduction catalyst for fuel cell and preparation method thereof | UNIV SHANGHAI JIAOTONG (CN) | 2008-11-19 | — | — | CN | disclosed |