⚠ 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 | |
|---|---|---|---|---|
| Pentenal SCHEMBL11942390 | 1.00 | — | — | |
| Pentenal SCHEMBL280610 | 1.00 | — | — | |
| Pentenal SCHEMBL27667541 | 0.91 | TRPA1 (0.82) | — | |
| SCHEMBL17294070 | 0.88 | TRPA1 (0.78) | — | |
| SCHEMBL811429 | 0.87 | TRPA1 (0.77) | — | |
| 2,4-Heptadienal SCHEMBL15681519 | 0.87 | — | — | |
| SCHEMBL1301402 | 0.87 | TRPA1 (0.77) | — | |
| 2,4-Heptadienal SCHEMBL2904837 | 0.87 | — | — | |
| SCHEMBL1300991 | 0.87 | TRPA1 (0.77) | — | |
| 2,4-Heptadienal SCHEMBL231267 | 0.87 | — | — |
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
Appears in 2240 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20260068882-A1 | ARTHROPOD CONTROLLING COMPOSITION | FIRMENICH & CIE (CH) | 2026-03-12 | — | — | US | claimed |
| EP-4680020-A1 | COMPOSITIONS INCLUDING ALDEHYDES WITH IMPROVED RELEASE RATE AND DEGRADATION PROPERTIES | FMC Agricultural Solutions A/S (DK) | 2026-01-21 | — | — | EP | claimed |
| EP-4619470-A1 | SILANE COMPOUND AND COMPOSITIONS CONTAINING SAME | Synthomer Sdn. Bhd. (MY) | 2025-09-24 | — | — | EP | claimed |
| US-20250280857-A1 | DEGRADATION-RESISTANT ALDEHYDE-CONTAINING COMPOSITIONS | ZOOMESSENCE INC (US) | 2025-09-11 | — | — | US | claimed |
| CN-120202247-A | Silane compound and composition containing same | 昕特玛私人有限公司 | 2025-06-24 | — | — | CN | claimed |
| WO-2025079402-A1 | HIGH-TEMPERATURE TOLERANCE INDUCER AND METHOD FOR INDUCING HIGH-TEMPERATURE TOLERANCE IN PLANTS | ＡＧＣ株式会社 | 2025-04-17 | — | — | WO | claimed |
| WO-2025079403-A1 | HIGH-TEMPERATURE TOLERANCE INDUCER AND METHOD FOR INDUCING HIGH-TEMPERATURE TOLERANCE IN PLANTS | ＡＧＣ株式会社 | 2025-04-17 | — | — | WO | claimed |
| CN-119812476-A | Electrolyte, battery pack and electric equipment | 比亚迪股份有限公司 | 2025-04-11 | — | — | CN | claimed |
| CN-113905612-B | Arthropod control composition | 弗门尼舍有限公司 | 2025-04-08 | — | — | CN | claimed |
| CN-119143578-A | Preparation method of m-methylbenzyl alcohol | 大连理工大学 | 2024-12-17 | — | — | CN | claimed |
| US-5945088-A | ORAL RINSE; ANTIPLAQUE AGENT | PFIZER INC (US) | 1999-08-31 | — | — | US | claimed |
| EP-0660724-B1 | IMPROVEMENTS IN OR RELATING TO CONTRAST AGENTS | NYCOMED IMAGING AS (NO) | 1998-07-01 | — | — | EP | claimed |
| EP-0835664-A2 | Improvements in or relating to contrast agents | NYCOMED AS (NO) | 1998-04-15 | — | — | EP | claimed |
| US-5718884-A | CROSSLINKED WITH A BIFUNCTIONAL ALDEHYDE AND STABILIZED BY REACTION WITH A REDUCING AGENT | NYCOMED IMAGING AS (NO) | 1998-02-17 | — | — | US | claimed |
| EP-0660724-A1 | IMPROVEMENTS IN OR RELATING TO CONTRAST AGENTS | NYCOMED IMAGING AS (NO) | 1995-07-05 | — | — | EP | claimed |
| US-5420347-A | Processes and intermediates for N-(S-3-alkyl-heptanoyl)-D-gamma-glutamyl-glycyl-D-alanine | PFIZER INC. (US) | 1995-05-30 | — | — | US | claimed |
| WO-1994006477-A1 | IMPROVEMENTS IN OR RELATING TO CONTRAST AGENTS | HOLMES, MICHAEL, JOHN (GB) | 1994-03-31 | — | — | WO | claimed |
| US-5286904-A | Processes and intermediates for N-(S-3-alkyl-heptanoyl)-D-gamma-glutamyl-glycyl-D-alanine | PFIZER INC. (US) | 1994-02-15 | — | — | US | claimed |
| US-5245079-A | Processes and intermediates for N-(S-3-alkyl-heptanoyl)-D-gamma-glutamyl-glycyl-D-alanine | PFIZER INC. (US) | 1993-09-14 | — | — | US | claimed |
| WO-1988001612-A1 | PROCESSES AND INTERMEDIATES FOR N-(S-3-ALKYL-HEPTANOYL)-D-GAMMA-GLUTAMYL-GLYCYL-D-ALANINE | PFIZER INC. (US) | 1988-03-10 | — | — | WO | claimed |