⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL178600 | 1.00 | — | — | |
| SCHEMBL178605 | 1.00 | — | — | |
| SCHEMBL7760040 | 0.87 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL7760037 | 0.87 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL3965582 | 0.86 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL3969911 | 0.86 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL8155788 | 0.86 | TSHR (0.38) | — | |
| SCHEMBL3969909 | 0.86 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL6291179 | 0.85 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL6290068 | 0.85 | SMN1; SMN2 (0.32) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0053979-B1 | CYCLOPENTANOL DERIVATIVES, THEIR PREPARATION, THEIR APPLICATION AS PERFUME AGENTS, THE COMPOSITIONS IN WHICH THESE PRODUCTS ARE INCORPORATED, AND THE INTERMEDIATES OBTAINED | ROUSSEL-UCLAF (FR) | 1985-07-10 | — | — | EP | claimed |
| EP-0977720-B1 | PERFUMES COMPRISING 3-ALKYLCYCLOALKANOLS | QUEST INT (NL) | 2002-06-19 | — | — | EP | disclosed |
| US-6313087-B1 | PERFUME COMPOSITION COMPRISING MIXTURE OF FRAGRANCE MATERIALS, INCLUDING AT LEAST ONE 3-ALKYLCYCLOALKANOL, PROVIDING MUGUET-TYPE ODOR NOTE TO SAID COMPOSITION | QUEST INTERNATIONAL BV (NL) | 2001-11-06 | — | — | US | disclosed |
| WO-2000013690-A1 | EXOCYCLIC-PHOSPHOETHANOLAMINES | CLARION PHARMACEUTICALS, INC. (US) | 2000-03-16 | — | — | WO | disclosed |
| EP-0977720-A1 | PERFUMES COMPRISING 3-ALKYLCYCLOALKANOLS | QUEST INTERNATIONAL B.V. (NL) | 2000-02-09 | — | — | EP | disclosed |
| WO-1998047842-A1 | PERFUMES COMPRISING 3-ALKYLCYCLOALKANOLS | QUEST INTERNATIONAL B.V. (NL) | 1998-10-29 | — | — | WO | disclosed |
| US-5804569-A | ANTIINFLAMMATORY, ANTIARRHYMIC AND LOCAL ANESTHETIC AGENT | CLARION PHARMACEUTICALS INC. (US) | 1998-09-08 | — | — | US | disclosed |
| EP-0053979-B1 | CYCLOPENTANOL DERIVATIVES, THEIR PREPARATION, THEIR APPLICATION AS PERFUME AGENTS, THE COMPOSITIONS IN WHICH THESE PRODUCTS ARE INCORPORATED, AND THE INTERMEDIATES OBTAINED | ROUSSEL-UCLAF (FR) | 1985-07-10 | — | — | EP | disclosed |
| US-4501687-A | ETHERS OR ESTERS THEREOF, IMPARTING PLEASANT ODOR | ROUSSEL UCLAF (FR) | 1985-02-26 | — | — | US | disclosed |
| EP-0053979-A2 | Cyclopentanol derivatives, their preparation, their application as perfume agents, the compositions in which these products are incorporated, and the intermediates obtained | ROUSSEL-UCLAF (FR) | 1982-06-16 | — | — | EP | disclosed |