⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8978619 | 1.00 | — | — | |
| SCHEMBL8978589 | 0.85 | SRD5A1 (0.48) | — | |
| SCHEMBL8978597 | 0.85 | SRD5A1 (0.48) | — | |
| SCHEMBL9211560 | 0.85 | SRD5A1 (0.53) | — | |
| SCHEMBL9211563 | 0.85 | SRD5A1 (0.53) | — | |
| SCHEMBL7531946 | 0.82 | — | — | |
| SCHEMBL7531955 | 0.82 | — | — | |
| SCHEMBL8978620 | 0.81 | SRD5A2 (0.47) | — | |
| SCHEMBL8978626 | 0.81 | SRD5A2 (0.47) | — | |
| SCHEMBL8978709 | 0.78 | SRD5A2 (0.64) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5583138-A | REDUCTASE INHIBITOR; SKIN DISORDERS | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1996-12-10 | — | — | US | disclosed |