⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20337248 | 1.00 | — | — | |
| SCHEMBL8997575 | 0.80 | CA14 (0.43) | — | |
| SCHEMBL600487 | 0.79 | — | — | |
| SCHEMBL7235464 | 0.79 | — | — | |
| SCHEMBL7235467 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL6626255 | 0.78 | CA14 (0.42) | — | |
| Hydrochloric Acid SCHEMBL31105856 | 0.77 | CYP1A2 (0.37) | — | |
| SCHEMBL598539 | 0.76 | — | — | |
| SCHEMBL9134952 | 0.75 | SCN9A (0.33) | — | |
| SCHEMBL3195946 | 0.73 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109311841-B | Heteroaryl-1, 2, 4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites | 瑞士伊兰科动物保健有限公司 | 2021-04-27 | — | — | CN | disclosed |
| US-10981897-B2 | Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites | ELANCO TIERGESUNDHEIT AG (US) | 2021-04-20 | — | — | US | disclosed |
| US-10981897-B2 | Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites | ELANCO TIERGESUNDHEIT AG (US) | 2021-04-20 | — | — | US | disclosed |
| EP-3452460-B1 | HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES | ELANCO TIERGESUNDHEIT AG (CH) | 2020-02-12 | — | — | EP | disclosed |
| US-20190256501-A1 | HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES | ELANCO TIERGESUNDHEIT AG (US) | 2019-08-22 | — | — | US | disclosed |
| US-20190256501-A1 | HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES | ELANCO TIERGESUNDHEIT AG (US) | 2019-08-22 | — | — | US | disclosed |
| US-10287276-B2 | Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites | ELANCO TIERGESUNDHEIT AG (CH) | 2019-05-14 | — | — | US | disclosed |
| US-10287276-B2 | Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites | ELANCO TIERGESUNDHEIT AG (CH) | 2019-05-14 | — | — | US | disclosed |
| CN-109311841-A | Heteroaryl-1, 2, 4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites | 瑞士伊兰科动物保健有限公司 | 2019-02-05 | — | — | CN | disclosed |
| US-20180186778-A1 | HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES | ELANCO TIERGESUNDHEIT AG (CH) | 2018-07-05 | — | — | US | disclosed |
| US-20180186778-A1 | HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES | ELANCO TIERGESUNDHEIT AG (CH) | 2018-07-05 | — | — | US | disclosed |
| US-20180186778-A1 | HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES | ELANCO TIERGESUNDHEIT AG (CH) | 2018-07-05 | — | — | US | disclosed |