⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL875137 | 1.00 | — | — | |
| SCHEMBL31345002 | 1.00 | — | — | |
| SCHEMBL2628274 | 1.00 | — | — | |
| SCHEMBL13957087 | 0.92 | SOAT1 (0.46) | — | |
| SCHEMBL9807358 | 0.90 | SOAT1 (0.49) | — | |
| SCHEMBL1301757 | 0.90 | SOAT1 (0.49) | — | |
| SCHEMBL2576352 | 0.90 | SOAT1 (0.49) | — | |
| SCHEMBL2880345 | 0.90 | SOAT1 (0.49) | — | |
| SCHEMBL22092458 | 0.90 | SOAT1 (0.49) | — | |
| SCHEMBL9807359 | 0.90 | SOAT1 (0.49) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023213310-A1 | CARBON CHAIN SUBSTANCE FOR REGULATING TRANSMEMBRANE TRANSPORT AND FLUIDITY OF CELL MEMBRANES, AND PREPARATION AND USE THEREOF | 太阳雨林(北京)生物医药有限公司 | 2023-11-09 | — | — | WO | disclosed |
| WO-2018018113-A1 | METHOD FOR PRODUCING SPILANTHOL AND ANALOGUES, THUS PRODUCED SPILANTHOL AND ANALOGUES | UNIVERSIDADE ESTADUAL DE CAMPINAS - UNICAMP (BR) | 2018-02-01 | — | — | WO | disclosed |
| WO-2012038197-A1 | COATING AGENT HAVING (METH)ACRYLIC POLYMERS AND COALESCENCE ADDITIVES | EVONIK RÖHM GMBH (DE) | 2012-03-29 | — | — | WO | disclosed |
| WO-2010112288-A1 | COATING AGENT, METHOD FOR PRODUCING A COATING AND COATED OBJECT | EVONIK RÖHM GMBH (DE) | 2010-10-07 | — | — | WO | disclosed |
| EP-0305913-B1 | PROCESS FOR THE PRODUCTION OF DIEN-1-OLS, 9-HYDROXYDODEC-10-ENYL-1-TERT.BUTYL ETHER, AND ITS USE AS AN INTERMEDIATE IN THE SYNTHESIS OF 8,10-DODECANE DIENOL | BASF Aktiengesellschaft (DE) | 1991-05-22 | — | — | EP | disclosed |
| US-4973765-A | Preparation of dien-1-ols, 9-hydroxydodec-10-enyl 1-tert-butyl ether and use thereof as an intermediate for synthesizing 8,10-dodecadienol | BASF AKTIENGESELLSCHAFT (DE) | 1990-11-27 | — | — | US | disclosed |
| US-4925991-A | CATALYSIS | BASF AKTIENGESELLSCHAFT (DE) | 1990-05-15 | — | — | US | disclosed |
| EP-0305913-A1 | Process for the production of dien-1-ols, 9-hydroxydodec-10-enyl-1-tert.butyl ether, and its use as an intermediate in the synthesis of 8,10-dodecane dienol | BASF Aktiengesellschaft (DE) | 1989-03-08 | — | — | EP | disclosed |