⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28715 | 0.76 | — | — | |
| SCHEMBL9726601 | 0.76 | — | — | |
| SCHEMBL2159350 | 0.76 | — | — | |
| SCHEMBL17373960 | 0.76 | EGLN1 (0.48) | — | |
| SCHEMBL18752932 | 0.74 | ECE1 (0.46) | — | |
| SCHEMBL8004720 | 0.74 | ALDH1A1 (0.50) | — | |
| SCHEMBL8497674 | 0.74 | ALDH1A1 (0.56) | — | |
| SCHEMBL8004724 | 0.74 | ALDH1A1 (0.50) | — | |
| SCHEMBL16371306 | 0.72 | MME (0.41) | — | |
| SCHEMBL14398066 | 0.72 | ALDH1A1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1268422-A1 | INDOLES FOR TREATING DISEASES THAT CAN BE TREATED USING THYROID HORMONES | Bayer Aktiengesellschaft (DE) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001070687-A1 | INDOLES FOR TREATING DISEASES THAT CAN BE TREATED USING THYROID HORMONES | BAYER AKTIENGESELLSCHAFT (DE) | 2001-09-27 | — | — | WO | disclosed |
| CN-1107145-A | Substituted heterocyclic carboxamides, their preparation and their use as pharmaceuticals | HOECHST AG (DE) | 1995-08-23 | — | — | CN | disclosed |