⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27984872 | 0.48 | — | — | |
| SCHEMBL10670011 | 0.44 | KDM4E (0.31) | — | |
| SCHEMBL14788285 | 0.40 | — | — | |
| SCHEMBL444840 | 0.39 | — | — | |
| SCHEMBL25165416 | 0.39 | MAPT (0.39) | — | |
| SCHEMBL28459806 | 0.39 | ALDH1A1 (0.35) | — | |
| SCHEMBL22246111 | 0.39 | CASP3 (0.37) | — | |
| Acetone SCHEMBL6009443 | 0.39 | LMNA (0.38) | — | |
| SCHEMBL6419590 | 0.39 | SMN1; SMN2 (0.37) | — | |
| Acetone SCHEMBL9722029 | 0.39 | TPMT (0.58) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7595139-B2 | Metal complex dye, color toner and color filter | KONICA MINOLTA HOLDINGS, INC. (JP) | 2009-09-29 | — | — | US | disclosed |
| US-7595139-B2 | Metal complex dye, color toner and color filter | KONICA MINOLTA HOLDINGS, INC. (JP) | 2009-09-29 | — | — | US | disclosed |