⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16611849 | 0.93 | — | — | |
| SCHEMBL6690843 | 0.84 | — | — | |
| SCHEMBL619373 | 0.84 | — | — | |
| SCHEMBL16611945 | 0.80 | — | — | |
| SCHEMBL15272282 | 0.72 | — | — | |
| SCHEMBL21101531 | 0.69 | UGT2B7 (0.31) | — | |
| SCHEMBL8947978 | 0.69 | PTPN2 (0.33) | — | |
| SCHEMBL1684041 | 0.68 | ADH1A (0.40) | — | |
| Cyclobutane Carbaldehyde SCHEMBL37814 | 0.68 | — | — | |
| SCHEMBL1684040 | 0.68 | ADH1A (0.40) | — |
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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113024506-B | Process for preparing 3-formyltetrahydrothiopyran compounds | 合肥工业大学 | 2022-05-20 | — | — | CN | claimed |
| CN-113024506-A | Process for preparing 3-formyltetrahydrothiopyran compounds | 合肥工业大学 | 2021-06-25 | — | — | CN | claimed |
| EP-0454867-B1 | A METHOD FOR THE SYNTHESIS OF $g(a), $g(b)-UNSATURATED KETONES | NIPPON SODA CO (JP) | 1995-02-01 | — | — | EP | claimed |
| EP-0141960-B1 | METHOD FOR THE PREPARATION OF TETRAHYDROTHIOPYRAN-3-CARBOXALDEHYDES | BASF Aktiengesellschaft (DE) | 1987-05-06 | — | — | EP | claimed |
| US-4629799-A | Preparation of 3-formyltetrahydrothiopyrans | BASF AKTIENGESELLSCHAFT (DE) | 1986-12-16 | — | — | US | claimed |
| US-4618362-A | USING CYCLOHEXAN-1,3-DIONE DERIVATIVE | BASF AKTIENGESELLSCHAFT (DE) | 1986-10-21 | — | — | US | claimed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| CN-113024506-B | Process for preparing 3-formyltetrahydrothiopyran compounds | 合肥工业大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-113024506-B | Process for preparing 3-formyltetrahydrothiopyran compounds | 合肥工业大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-113024506-B | Process for preparing 3-formyltetrahydrothiopyran compounds | 合肥工业大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-113024506-A | Process for preparing 3-formyltetrahydrothiopyran compounds | 合肥工业大学 | 2021-06-25 | — | — | CN | disclosed |
| CN-113024506-A | Process for preparing 3-formyltetrahydrothiopyran compounds | 合肥工业大学 | 2021-06-25 | — | — | CN | disclosed |
| CN-113024506-A | Process for preparing 3-formyltetrahydrothiopyran compounds | 合肥工业大学 | 2021-06-25 | — | — | CN | disclosed |
| EP-0233455-A1 | Hydrogenation and reduction by means of the hydrocarbon/carbon system | BASF Aktiengesellschaft (DE) | 1987-08-26 | — | — | EP | disclosed |
| EP-0141960-B1 | METHOD FOR THE PREPARATION OF TETRAHYDROTHIOPYRAN-3-CARBOXALDEHYDES | BASF Aktiengesellschaft (DE) | 1987-05-06 | — | — | EP | disclosed |
| US-4629799-A | Preparation of 3-formyltetrahydrothiopyrans | BASF AKTIENGESELLSCHAFT (DE) | 1986-12-16 | — | — | US | disclosed |
| US-4629799-A | Preparation of 3-formyltetrahydrothiopyrans | BASF AKTIENGESELLSCHAFT (DE) | 1986-12-16 | — | — | US | disclosed |
| US-4629799-A | Preparation of 3-formyltetrahydrothiopyrans | BASF AKTIENGESELLSCHAFT (DE) | 1986-12-16 | — | — | US | disclosed |
| EP-0141960-A1 | Method for the preparation of tetrahydrothiopyran-3-carboxaldehydes | BASF Aktiengesellschaft (DE) | 1985-05-22 | — | — | EP | disclosed |
| EP-0141960-A1 | Method for the preparation of tetrahydrothiopyran-3-carboxaldehydes | BASF Aktiengesellschaft (DE) | 1985-05-22 | — | — | EP | disclosed |