⚠ 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 | |
|---|---|---|---|---|
| Benzylamine SCHEMBL28836785 | 0.82 | LOXL2 (0.45) | — | |
| SCHEMBL16489116 | 0.78 | — | — | |
| SCHEMBL8638891 | 0.77 | ACHE (0.34) | — | |
| SCHEMBL918758 | 0.76 | PIK3CD (0.31) | — | |
| SCHEMBL9360177 | 0.76 | ACHE (0.37) | — | |
| SCHEMBL8640870 | 0.76 | ACHE (0.37) | — | |
| SCHEMBL8636592 | 0.76 | ACHE (0.37) | — | |
| SCHEMBL10967660 | 0.73 | — | — | |
| SCHEMBL1187811 | 0.70 | HSP90AB1 (0.38) | — | |
| SCHEMBL28585895 | 0.69 | MEN1 (0.48) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11197891-B2 | Therapies with lanthionine C-like protein 2 ligands and cells prepared therewith | LANDOS BIOPHARMA, INC. (US) | 2021-12-14 | — | — | US | disclosed |
| US-20190160100-A1 | THERAPIES WITH LANTHIONINE C-LIKE PROTEIN 2 LIGANDS AND CELLS PREPARED THEREWITH | LANDOS BIOPHARMA, INC. (US) | 2019-05-30 | — | — | US | disclosed |
| US-8003662-B2 | Heterobicyclic thiophene compounds and methods of use | ARRAY BIOPHARMA, INC. (US) | 2011-08-23 | — | — | US | disclosed |
| US-20070197537-A1 | Heterobicyclic thiophene compounds and methods of use | ARRAY BIOPHARMA, INC. | 2007-08-23 | — | — | US | disclosed |
| WO-1992010501-A1 | HERBICIDAL ETHERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-06-25 | — | — | WO | disclosed |
| US-4670041-A | PLANT GROWTH REGULATORS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-06-02 | — | — | US | disclosed |
| EP-0081892-B1 | PROCESS FOR THE PREPARATION OF BICYCLOHEPTANE DERIVATIVES, AND NOVEL BICYCLOHEPTANE DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-03-18 | — | — | EP | disclosed |
| EP-0081893-B1 | OXABICYCLOALKANE HERBICIDES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-03-04 | — | — | EP | disclosed |
| US-4567283-A | EPOXYCYCLOHEXANOLS | SHELL OIL COMPANY (US) | 1986-01-28 | — | — | US | disclosed |
| US-4554366-A | HERBICIDES, PLANT GROWTH REGULATORS | SHELL OIL COMPANY (US) | 1985-11-19 | — | — | US | disclosed |
| US-4542244-A | Oxabicycloalkane herbicides | SHELL OIL COMPANY (US) | 1985-09-17 | — | — | US | disclosed |
| US-4487945-A | ACIDIFYING A CIS-EPOXYCYCLOHEXANOL | SHELL OIL COMPANY (US) | 1984-12-11 | — | — | US | disclosed |
| EP-0081892-A2 | Process for the preparation of bicycloheptane derivatives, and novel bicycloheptane derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1983-06-22 | — | — | EP | disclosed |
| EP-0081893-A2 | Oxabicycloalkane herbicides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1983-06-22 | — | — | EP | disclosed |