⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9048609 | 1.00 | — | — | |
| SCHEMBL9875831 | 0.79 | — | — | |
| SCHEMBL11357918 | 0.78 | — | — | |
| SCHEMBL11357920 | 0.78 | — | — | |
| SCHEMBL11304750 | 0.72 | — | — | |
| SCHEMBL6207578 | 0.72 | — | — | |
| SCHEMBL6207575 | 0.72 | — | — | |
| SCHEMBL11304746 | 0.72 | — | — | |
| SCHEMBL9007444 | 0.69 | — | — | |
| SCHEMBL10538564 | 0.68 | — | — |
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-5449844-A | Chemical condensation in the presence of acid catalyst | RHONE-POULENC NUTRITION ANIMALE (FR) | 1995-09-12 | — | — | US | disclosed |
| US-4900858-A | Process for the preparation of a 6-halo-3-methyl-1-trialkylsilyloxy-1,3,5-hexatriene | RHONE-POULENC SANTE (FR) | 1990-02-13 | — | — | US | disclosed |
| US-4876370-A | 1,3,5-nonatriene derivatives, their preparation and their use | RHONE-POULENC SANTE (FR) | 1989-10-24 | — | — | US | disclosed |