⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3432799 | 0.85 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL2570839 | 0.84 | ACHE (0.31) | — | |
| SCHEMBL2566567 | 0.81 | ALDH1A3 (0.32) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL2572040 | 0.80 | GPR3 (0.31) | — | |
| Cyclohexane SCHEMBL2574992 | 0.77 | LTB4R (0.31) | — | |
| SCHEMBL2569744 | 0.76 | CYP1A2 (0.33) | — | |
| SCHEMBL3776616 | 0.74 | SLC22A12 (0.34) | — | |
| SCHEMBL1344967 | 0.72 | ALDH1A3 (0.39) | — | |
| SCHEMBL3777140 | 0.71 | HSD11B1 (0.35) | — | |
| Tromethamine SCHEMBL3420453 | 0.71 | PLA2G4A (0.33) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8455176-B2 | Coating composition | AZ ELECTRONIC MATERIALS USA CORP. (US) | 2013-06-04 | — | — | US | claimed |
| US-20100119972-A1 | COATING COMPOSITION | MERCK PATENT GMBH (DE) | 2010-05-13 | — | — | US | claimed |
| EP-2384457-B1 | COATING COMPOSITIONS | MERCK PATENT GMBH (DE) | 2022-07-06 | — | — | EP | disclosed |
| US-9146467-B2 | Coating compositions | MERCK PATENT GMBH (DE) | 2015-09-29 | — | — | US | disclosed |
| US-20130236833-A1 | COATING COMPOSITIONS | AZ ELECTRONIC MATERIALS USA CORP. (US) | 2013-09-12 | — | — | US | disclosed |
| US-8455176-B2 | Coating composition | AZ ELECTRONIC MATERIALS USA CORP. (US) | 2013-06-04 | — | — | US | disclosed |
| US-20100119972-A1 | COATING COMPOSITION | MERCK PATENT GMBH (DE) | 2010-05-13 | — | — | US | disclosed |