⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14657575 | 0.65 | — | — | |
| SCHEMBL3769129 | 0.65 | PIK3CD (0.34) | — | |
| Water SCHEMBL29258023 | 0.63 | PIK3CD (0.33) | — | |
| Bromide SCHEMBL3052220 | 0.63 | PIK3CD (0.33) | — | |
| SCHEMBL10147170 | 0.58 | — | — | |
| SCHEMBL11419885 | 0.58 | — | — | |
| SCHEMBL24209746 | 0.57 | PIK3CD (0.61) | — | |
| SCHEMBL20438377 | 0.57 | PIK3CD (0.61) | — | |
| SCHEMBL9851586 | 0.57 | PIK3CD (0.44) | — | |
| SCHEMBL1621691 | 0.57 | PIK3CD (0.61) | — |
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-20160114057-A1 | MODULAR PROTEIN DRUG CONJUGATE THERAPEUTIC | ZYEWORKS INC. (CA) | 2016-04-28 | — | — | US | disclosed |
| US-9315864-B2 | Heteroarylcyanine dyes with sulfonic acid substituents | PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) | 2016-04-19 | — | — | US | disclosed |
| US-20140080127-A1 | HETEROARYLCYANINE DYES | PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) | 2014-03-20 | — | — | US | disclosed |