⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21133086 | 0.80 | — | — | |
| SCHEMBL15128050 | 0.80 | MEN1 (0.40) | — | |
| SCHEMBL23433083 | 0.78 | HDAC3 (0.31) | — | |
| SCHEMBL18885698 | 0.77 | ALDH1A1 (0.31) | — | |
| SCHEMBL13759978 | 0.77 | — | — | |
| SCHEMBL15258553 | 0.76 | FFAR1 (0.32) | — | |
| SCHEMBL19001556 | 0.75 | STING1 (0.31) | — | |
| SCHEMBL12944239 | 0.75 | STING1 (0.31) | — | |
| SCHEMBL23745105 | 0.75 | STING1 (0.31) | — | |
| SCHEMBL18272089 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9839687-B2 | Acetylenedicarboxyl linkers and their uses in specific conjugation of a cell-binding molecule | SUZHOU M-CONJ BIOTECH CO., LTD. (CN) | 2017-12-12 | — | — | US | disclosed |
| US-20170202975-A1 | DISULFUR BRIDGE LINKERS FOR CONJUGATION OF A CELL-BINDING MOLECULE | SUZHOU M-CONJ BIOTECH CO., LTD. (CN) | 2017-07-20 | — | — | US | disclosed |
| US-20170151346-A1 | DISULFUR BRIDGE LINKERS FOR CONJUGATION OF A CELL-BINDING MOLECULE | SUZHOU M-CONJ BIOTECH CO., LTD. (CN) | 2017-06-01 | — | — | US | disclosed |