⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11632707 | 0.95 | — | — | |
| SCHEMBL11630229 | 0.85 | GAA (0.32) | — | |
| SCHEMBL11634557 | 0.84 | GAA (0.30) | — | |
| SCHEMBL11633590 | 0.80 | CA12 (0.30) | — | |
| SCHEMBL11633157 | 0.79 | — | — | |
| SCHEMBL11634634 | 0.77 | KMT2A (0.39) | — | |
| SCHEMBL11634138 | 0.76 | GAA (0.34) | — | |
| SCHEMBL11635108 | 0.75 | GAA (0.30) | — | |
| SCHEMBL11630434 | 0.74 | — | — | |
| SCHEMBL11634574 | 0.74 | — | — |
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-4111937-A | IODINATED ANILIC ACIDS | STERLING DRUG INC. (US) | 1978-09-05 | — | — | US | disclosed |
| US-4031088-A | Iodinated anilic acids | STERLING DRUG INC. (US) | 1977-06-21 | — | — | US | disclosed |