⚠ 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 | |
|---|---|---|---|---|
| Carbamic Acid SCHEMBL11503639 | 0.85 | ACHE (0.54) | — | |
| Carbamic Acid SCHEMBL16971307 | 0.85 | — | — | |
| Acetone SCHEMBL6854699 | 0.84 | — | — | |
| Acetamide SCHEMBL115226 | 0.80 | — | — | |
| Acetic Acid SCHEMBL8327416 | 0.80 | — | — | |
| Acetamide SCHEMBL3612730 | 0.80 | LMNA (0.67) | — | |
| Acetamide SCHEMBL36969 | 0.80 | — | — | |
| Acetamide SCHEMBL17847056 | 0.80 | LMNA (0.67) | — | |
| Acetamide SCHEMBL27763014 | 0.80 | — | — | |
| Acetamide SCHEMBL10345077 | 0.79 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6114364-A | 2-((SUBSTITUTED)ALKYL(THIO, SULFONYL, OR SULFOXY)METHYL), 3-(CARBOXYL OR ALIPHATIC HYDROCARBONYL)CYCLOPENTAN-1-ONE DERIVATIVES, EXCEPT CYSTACYCLIN; USE AS NEURON DIFFERENTIATION ACCELERATOR | NIPPON KAYAKU CO., LTD. (JP) | 2000-09-05 | — | — | US | disclosed |
| EP-0976709-A1 | 2,3-DISUBSTITUTED CYCLOPENTANONE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL USE THEREOF | NIPPON KAYAKU CO., LTD. (JP) | 2000-02-02 | — | — | EP | disclosed |
| US-5468888-A | Lupane derivatives, their preparation and the pharmaceutical compositions which contain them | RHONE-POULENC RORER S.A. (FR) | 1995-11-21 | — | — | US | disclosed |
| EP-0613483-A1 | NEW LUPANE DERIVATIVES, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Aventis Pharma S.A. (FR) | 1994-09-07 | — | — | EP | disclosed |
| WO-1993010142-A1 | NEW LUPANE DERIVATIVES, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | RHONE-POULENC RORER S.A. (FR) | 1993-05-27 | — | — | WO | disclosed |
| EP-0542622-A1 | New lupane derivatives, a process for their production and pharmaceutical compositions containing them | Aventis Pharma S.A. (FR) | 1993-05-19 | — | — | EP | disclosed |