⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27506086 | 0.92 | — | — | |
| SCHEMBL2425068 | 0.90 | PAOX (0.45) | — | |
| SCHEMBL226644 | 0.83 | — | — | |
| SCHEMBL20146210 | 0.75 | — | — | |
| SCHEMBL8939134 | 0.74 | EPHX1 (0.61) | — | |
| SCHEMBL7899856 | 0.74 | EPHX1 (0.61) | — | |
| SCHEMBL6945997 | 0.74 | EPHX1 (0.61) | — | |
| SCHEMBL8939098 | 0.74 | EPHX1 (0.61) | — | |
| SCHEMBL2204977 | 0.72 | — | — | |
| SCHEMBL9302179 | 0.71 | CA12 (0.47) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105407729-B | Wrap polyamine-containing composition and method | 库扎环球有限责任公司 | 2018-01-02 | — | — | CN | disclosed |
| CN-105622507-A | Naphthalimide derivative and preparing method and application thereof | UNIV HENAN | 2016-06-01 | — | — | CN | disclosed |
| WO-2007023998-A1 | HALOGENATED POLYAMIDE ACID COMPOSITION AND ITS APPLICATIONS | NIPPON SHOKUBAI CO., LTD. (JP) | 2007-03-01 | — | — | WO | disclosed |
| CN-1833033-A | Methods and materials for identifying agents which modulate bone remodeling and agents identified thereby | WYETH CORP (US) | 2006-09-13 | — | — | CN | disclosed |