⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29550347 | 0.61 | HIF1A (0.38) | — | |
| SCHEMBL1738692 | 0.61 | ENPP2 (0.46) | — | |
| SCHEMBL12967454 | 0.60 | KDM4E (0.43) | — | |
| SCHEMBL27961328 | 0.59 | ADRA1D (0.39) | — | |
| SCHEMBL4575201 | 0.58 | MAPK1 (0.35) | — | |
| SCHEMBL1738690 | 0.57 | GRM2 (0.45) | — | |
| SCHEMBL28758223 | 0.56 | KMT2A (0.35) | — | |
| SCHEMBL28785804 | 0.56 | L3MBTL1 (0.34) | — | |
| SCHEMBL28124070 | 0.55 | KMT2A (0.49) | — | |
| SCHEMBL16443971 | 0.55 | CA2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008039087-A2 | INDOLINE DERIVATIVES AND USES THEREOF | AUCKLAND UNISERVICES LIMITED (NZ) | 2008-04-03 | — | — | WO | claimed |
| WO-2008039087-A2 | INDOLINE DERIVATIVES AND USES THEREOF | AUCKLAND UNISERVICES LIMITED (NZ) | 2008-04-03 | — | — | WO | disclosed |