⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16013775 | 0.72 | — | — | |
| SCHEMBL3025 | 0.70 | — | — | |
| SCHEMBL27737320 | 0.70 | ALDH1A1 (0.50) | — | |
| Acetic Acid Methyl Ester SCHEMBL16144520 | 0.69 | — | — | |
| SCHEMBL26688664 | 0.67 | — | — | |
| SCHEMBL28176468 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL28307052 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL18490013 | 0.67 | — | — | |
| SCHEMBL8749615 | 0.67 | — | — | |
| Bromide SCHEMBL27709856 | 0.67 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20260042781-A1 | Bicyclic Ureas As Kinase Inhibitors | INCYTE CORP (US) | 2026-02-12 | — | — | US | disclosed |
| EP-4683713-A1 | DEUTERATED P2X3 MODULATORS | GlaxoSmithKline Intellectual Property (No.3) Limited (GB) | 2026-01-28 | — | — | EP | disclosed |
| WO-2024194352-A1 | DEUTERATED P2X3 MODULATORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.3) LIMITED (GB) | 2024-09-26 | — | — | WO | disclosed |
| CN-112939814-A | Preparation method of deuterated daclatasvir intermediate | 正大天晴药业集团股份有限公司 | 2021-06-11 | — | — | CN | disclosed |
| US-20100029716-A1 | NOVEL 1,2,3,4- TETRAHYDROQUINOLINE DERIVATIVES | CONCERT PHARMACEUTICALS, INC. (US) | 2010-02-04 | — | — | US | disclosed |
| WO-2009148600-A2 | DEUTERATED LYSINE-BASED COMPOUNDS | CONCERT PHARMACEUTICALS, INC. (US) | 2009-12-10 | — | — | WO | disclosed |
| EP-2003120-A1 | Azapeptide derivatives as HIV protease inhibitors | Concert Pharmaceuticals Inc. (US) | 2008-12-17 | — | — | EP | disclosed |
| WO-2007120621-A2 | NONEL 1,2,3,4-TETRAHYDROQUINOLINE DERIVATIVES | CONCERT PHARMACEUTICALS, INC. (US) | 2007-10-25 | — | — | WO | disclosed |
| US-5786218-A | INFRARED ANALYSIS BY REACTING WITH A DEUTERIUM CONTAINING REAGENT | ZENECA LIMITED (GB) | 1998-07-28 | — | — | US | disclosed |