⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16046579 | 0.76 | CYP19A1 (0.36) | — | |
| SCHEMBL3630532 | 0.73 | CYP3A4 (0.43) | — | |
| SCHEMBL8731685 | 0.73 | CYP3A4 (0.43) | — | |
| SCHEMBL19657437 | 0.73 | CYP3A4 (0.36) | — | |
| SCHEMBL3150036 | 0.73 | CYP3A4 (0.43) | — | |
| SCHEMBL10892646 | 0.70 | — | — | |
| SCHEMBL1639680 | 0.67 | ACE2 (0.40) | — | |
| SCHEMBL5605630 | 0.67 | CYP3A4 (0.32) | — | |
| SCHEMBL11310612 | 0.66 | — | — | |
| SCHEMBL19167949 | 0.65 | CYP3A4 (0.31) | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11840511-B2 | Haloacetaldehyde alkyl 2-cyclopentenyl acetal compound and a process for preparing the same, a process for preparing a (2-cyclopentenyl)acetate ester compound therefrom, and a process for preparing a (2-cyclopentenyl)acetic acid compound therefrom | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-12-12 | — | — | US | disclosed |
| US-11840511-B2 | Haloacetaldehyde alkyl 2-cyclopentenyl acetal compound and a process for preparing the same, a process for preparing a (2-cyclopentenyl)acetate ester compound therefrom, and a process for preparing a (2-cyclopentenyl)acetic acid compound therefrom | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-12-12 | — | — | US | disclosed |
| EP-4101834-B1 | HALOACETALDEHYDE ALKYL 2-CYCLOPENTENYL ACETAL COMPOUND AND A PROCESS FOR PREPARING THE SAME, A PROCESS FOR PREPARING A (2-CYCLOPENTENYL)ACETATE ESTER COMPOUND THEREFROM, AND A PROCESS FOR PREPARING A (2-CYCLOPENTENYL)ACETIC ACID COMPOUND THEREFROM | SHINETSU CHEMICAL CO (JP) | 2023-11-22 | — | — | EP | disclosed |
| EP-4101832-B1 | A PROCESS FOR PREPARING 2-(1,5,5-TRIMETHYL-2-CYCLOPENTENYL)ETHYL ACETATE | SHINETSU CHEMICAL CO (JP) | 2023-11-15 | — | — | EP | disclosed |
| US-20230002304-A1 | HALOACETALDEHYDE ALKYL 2-CYCLOPENTENYL ACETAL COMPOUND AND A PROCESS FOR PREPARING THE SAME, A PROCESS FOR PREPARING A (2-CYCLOPENTENYL)ACETATE ESTER COMPOUND THEREFROM, AND A PROCESS FOR PREPARING A (2-CYCLOPENTENYL)ACETIC ACID COMPOUND THEREFROM | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-01-05 | — | — | US | disclosed |
| US-20230002307-A1 | PROCESS FOR PREPARING 2-(1,5,5-TRIMETHYL-2-CYCLOPENTENYL)ETHYL ACETATE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-01-05 | — | — | US | disclosed |
| EP-4101832-A1 | A PROCESS FOR PREPARING 2-(1,5,5-TRIMETHYL-2-CYCLOPENTENYL)ETHYL ACETATE | Shin-Etsu Chemical Co., Ltd. (JP) | 2022-12-14 | — | — | EP | disclosed |
| EP-4101834-A2 | HALOACETALDEHYDE ALKYL 2-CYCLOPENTENYL ACETAL COMPOUND AND A PROCESS FOR PREPARING THE SAME, A PROCESS FOR PREPARING A (2-CYCLOPENTENYL)ACETATE ESTER COMPOUND THEREFROM, AND A PROCESS FOR PREPARING A (2-CYCLOPENTENYL)ACETIC ACID COMPOUND THEREFROM | Shin-Etsu Chemical Co., Ltd. (JP) | 2022-12-14 | — | — | EP | disclosed |
| US-10221122-B2 | Enantiospecific process for the preparation of (R) and (S) enantiomers of sex pheromonoes of the long tailed mealy bug | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2019-03-05 | — | — | US | disclosed |
| US-20180134650-A1 | AN ENANTIOSPECIFIC PROCESS FOR THE PREPARATION OF (R) AND (S) ENANTIOMERS OF SEX PHEROMONOES OF THE LONG TAILED MEALY BUG | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2018-05-17 | — | — | US | disclosed |
| US-20180134650-A1 | AN ENANTIOSPECIFIC PROCESS FOR THE PREPARATION OF (R) AND (S) ENANTIOMERS OF SEX PHEROMONOES OF THE LONG TAILED MEALY BUG | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2018-05-17 | — | — | US | disclosed |
| US-9598346-B2 | Enantioselective process for the preparation of enantiomers of sex pheromones | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2017-03-21 | — | — | US | disclosed |
| US-9598346-B2 | Enantioselective process for the preparation of enantiomers of sex pheromones | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2017-03-21 | — | — | US | disclosed |
| WO-2016181413-A1 | AN ENANTIOSPECIFIC PROCESS FOR THE PREPARATION OF (R) AND (S) ENANTIOMERS OF SEX PHEROMONESOF THE LONG TAILED MEALY BUG | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2016-11-17 | — | — | WO | disclosed |
| US-20150361025-A1 | ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF ENANTIOMERS OF SEX PHEROMONES | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2015-12-17 | — | — | US | disclosed |
| US-20150361025-A1 | ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF ENANTIOMERS OF SEX PHEROMONES | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2015-12-17 | — | — | US | disclosed |
| WO-2014115172-A1 | ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF ENANTIOMERS OF SEX PHEROMONES | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2014-07-31 | — | — | WO | disclosed |