⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8388120 | 0.85 | LPAR3 (0.57) | — | |
| SCHEMBL8384728 | 0.83 | LPAR3 (0.64) | — | |
| SCHEMBL8961324 | 0.81 | LPAR3 (0.68) | — | |
| SCHEMBL30864478 | 0.81 | LPAR3 (0.68) | — | |
| SCHEMBL8386987 | 0.81 | LPAR3 (0.68) | — | |
| SCHEMBL27042274 | 0.81 | LPAR3 (0.57) | — | |
| SCHEMBL4434842 | 0.78 | MPI (0.32) | — | |
| SCHEMBL28414597 | 0.78 | ALDH1A1 (0.46) | — | |
| SCHEMBL585242 | 0.77 | — | — | |
| SCHEMBL12478462 | 0.77 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113301986-B | Vegetable oil composition for coating particles | 阿科玛法国公司 | 2023-10-20 | — | — | CN | disclosed |
| WO-2023017787-A1 | ANAEROBIC ADHESIVE COMPOSITION | 大倉工業株式会社 | 2023-02-16 | — | — | WO | disclosed |
| WO-2023017788-A1 | ANAEROBIC ADHESIVE COMPOSITION | 大倉工業株式会社 | 2023-02-16 | — | — | WO | disclosed |
| US-11162120-B2 | Enzymatic production of an acyl phosphate from a 2-hydroxyaldehyde | Scientist of Fortune, S.A. (LU) | 2021-11-02 | — | — | US | disclosed |
| EP-3833699-A1 | NOVEL COMPOSITIONS AND METHODS TO PRODUCE ALKOXYLATED TRIAZINE-ARYLHYDROXY-ALDEHYDE CONDENSATES | Hexion Research Belgium SA (BE) | 2021-06-16 | — | — | EP | disclosed |
| US-20200248215-A1 | ENZYMATIC PRODUCTION OF AN ACYL PHOSPHATE FROM A 2-HYDROXYALDEHYDE | Scientist of Fortune, S.A. (LU) | 2020-08-06 | — | — | US | disclosed |
| WO-2020023305-A1 | NOVEL COMPOSITIONS AND METHODS TO PRODUCE ALKOXYLATED TRIAZINE-ARYLHYDROXY-ALDEHYDE CONDENSATES | HEXION INC. (US) | 2020-01-30 | — | — | WO | disclosed |
| US-8372621-B2 | Methods and materials for the production of shikimic acid | BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY (US) | 2013-02-12 | — | — | US | disclosed |
| US-8311790-B2 | Reverse engineering genome-scale metabolic network reconstructions for organisms with incomplete genome annotation and developing constraints using proton flux states and numerically-determined sub-systems | UNIVERSITY OF DELAWARE (US) | 2012-11-13 | — | — | US | disclosed |
| US-20110045539-A1 | Methods and Materials for the Production of Shikimic Acid | BOARD OF TRUSTEES OPERATING MICHIGAN UNIVERSITY (US) | 2011-02-24 | — | — | US | disclosed |
| US-20090259451-A1 | REVERSE ENGINEERING GENOME-SCALE METABOLIC NETWORK RECONSTRUCTIONS FOR ORGANISMS WITH INCOMPLETE GENOME ANNOTATION AND DEVELOPING CONSTRAINTS USING PROTON FLUX STATES AND NUMERICALLY-DETERMINED SUB-SYSTEMS | UNIVERSITY OF DELAWARE (US) | 2009-10-15 | — | — | US | disclosed |
| EP-1255790-B1 | NOVEL SURFACE-MODIFIED PEARL PIGMENT AND PROCESS FOR PRODUCING THE SAME | MERCK PATENT GMBH (DE) | 2007-04-18 | — | — | EP | disclosed |
| US-6858072-B1 | Surface-modified pearl pigment and process for producing the same | MERCK PATENT GMBH (DE) | 2005-02-22 | — | — | US | disclosed |
| EP-0487343-B1 | Process for preparing a lithographic plate | FUJI PHOTO FILM CO LTD (JP) | 1999-04-28 | — | — | EP | disclosed |
| EP-0487343-A1 | Process for preparing a lithographic plate | Fuji Photo Film Co., Ltd. (JP) | 1992-05-27 | — | — | EP | disclosed |