⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2541080 | 0.70 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL9569702 | 0.67 | LMNA (0.49) | — | |
| SCHEMBL4438451 | 0.66 | — | — | |
| SCHEMBL71329 | 0.60 | — | — | |
| SCHEMBL7568984 | 0.60 | SMN1; SMN2 (0.48) | — | |
| SCHEMBL11772819 | 0.60 | CA1 (0.36) | — | |
| SCHEMBL7463378 | 0.60 | — | — | |
| SCHEMBL83058 | 0.58 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL10438993 | 0.57 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL15763954 | 0.57 | CA1 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015080675-A1 | MOLECULAR WEIGHT ENHANCING AGENT OF POLYESTER COMPRISING AMIDOALKYLIDENE MALONATE, A PROCESS OF ENHANCING MOLECULAR WEIGHT AND POLYESTER OBTAINED FROM SAID MOLECULAR WEIGHT ENHANCING AGENT | PTT GLOBAL CHEMICAL PUBLIC COMPANY LIMITED (TH) | 2015-06-04 | — | — | WO | disclosed |