⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7155300 | 0.83 | TSHR (0.50) | — | |
| SCHEMBL28305438 | 0.83 | TSHR (0.50) | — | |
| SCHEMBL9007915 | 0.83 | TSHR (0.50) | — | |
| SCHEMBL25996485 | 0.80 | TSHR (0.48) | — | |
| SCHEMBL136233 | 0.80 | — | — | |
| SCHEMBL1184928 | 0.79 | — | — | |
| SCHEMBL3076033 | 0.79 | — | — | |
| SCHEMBL28537177 | 0.79 | TSHR (0.52) | — | |
| SCHEMBL1266469 | 0.78 | TSHR (0.35) | — | |
| SCHEMBL3431156 | 0.77 | TSHR (0.63) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8183270-B2 | Insecticidal N-substituted (2-substituted-1,3-thiazol)alkyl sulfoximines | DOW AGROSCIENCES, LLC (US) | 2012-05-22 | — | — | US | disclosed |
| US-20110060018-A1 | INSECTICIDAL N-SUBSTITUTED (2-SUBSTITUTED-1,3-THIAZOL)ALKYL SULFOXIMINES | CORTEVA AGRISCIENCE LLC | 2011-03-10 | — | — | US | disclosed |
| US-7897592-B2 | HIV integrase inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-03-01 | — | — | US | disclosed |
| US-7863303-B2 | Insecticidal N-substituted (2-substituted-1,3-thiazol)alkyl sulfoximines | DOW AGROSCIENCES LLC (US) | 2011-01-04 | — | — | US | disclosed |
| US-20080058394-A1 | Insecticidal N-substituted (2-substituted-1,3-thiazol)alkyl sulfoximines | DOW AGROSCIENCES LLC (US) | 2008-03-06 | — | — | US | disclosed |
| US-20070112190-A1 | HIV integrase inhibitors | BRISTOL-MYERS SQUIBB COMPANY | 2007-05-17 | — | — | US | disclosed |
| US-5876830-A | Method of assembly of molecular-sized nets and scaffolding | BOARD OF REGENTS OF THE UNIVERSITY OF COLORADO (US) | 1999-03-02 | — | — | US | disclosed |
| WO-1997009158-A1 | METHOD OF ASSEMBLY OF MOLECULAR-SIZED NETS AND SCAFFOLDING | BOARD OF REGENTS OF THE UNIVERSITY OF COLORADO (US) | 1997-03-13 | — | — | WO | disclosed |
| US-4328238-A | ANTIDEPRESSANTS, ANTISECRETORY, AND ANTIULCER AGENTS | SANKYO COMPANY LIMITED (JP) | 1982-05-04 | — | — | US | disclosed |
| US-4080461-A | PESTICIDES, FUNGICIDES | SYNTEX (U.S.A.) INC. (US) | 1978-03-21 | — | — | US | disclosed |
| US-4002640-A | ANTIFUNGAL AGENTS | SYNTEX (U.S.A.) INC. (US) | 1977-01-11 | — | — | US | disclosed |