⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL127172 | 0.81 | — | — | |
| SCHEMBL28203704 | 0.78 | — | — | |
| SCHEMBL11290325 | 0.78 | — | — | |
| SCHEMBL8772925 | 0.78 | — | — | |
| SCHEMBL711723 | 0.78 | — | — | |
| SCHEMBL14814574 | 0.76 | THRB (0.35) | — | |
| SCHEMBL712368 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL711314 | 0.74 | DNM1 (0.43) | — | |
| SCHEMBL6673142 | 0.74 | CA2 (0.33) | — | |
| SCHEMBL711614 | 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 179 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4940492-A | Colorant mixtures containing isoquinoline derivatives, use thereof in printing inks, and novel isoquinoline derivatives | BASF AKTIENGESELLSCHAFT (DE) | 1990-07-10 | — | — | US | claimed |
| EP-3191471-B1 | 4,5-DIHYDROPYRAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY | ABBVIE DEUTSCHLAND (DE) | 2020-03-11 | — | — | EP | disclosed |
| US-20180265481-A1 | METHOD FOR PREPARATION OF CERTAIN 1,5 DISUBSTITUTED TETRAZOLES | LONZA LTD. (CH) | 2018-09-20 | — | — | US | disclosed |
| EP-3221305-B1 | METHOD FOR PREPARATION OF CERTAIN 1,5 DISUBSTITUTED TETRAZOLES | LONZA AG (CH) | 2018-03-07 | — | — | EP | disclosed |
| EP-3221305-A1 | METHOD FOR PREPARATION OF CERTAIN 1,5 DISUBSTITUTED TETRAZOLES | Lonza Ltd (CH) | 2017-09-27 | — | — | EP | disclosed |
| EP-3191471-A1 | 4,5-DIHYDROPYRAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY | AbbVie Deutschland GmbH & Co. KG (DE) | 2017-07-19 | — | — | EP | disclosed |
| US-9550754-B2 | 4,5-dihydropyrazole derivatives, pharmaceutical compositions containing them, and their use in therapy | AbbVie Deutschland GmbH & Co. KG (DE) | 2017-01-24 | — | — | US | disclosed |
| EP-3112344-A1 | METHOD FOR PREPARATION OF CERTAIN THIOACETAMIDES | Lonza Ltd (CH) | 2017-01-04 | — | — | EP | disclosed |
| EP-2826773-B1 | COMPOUND, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PURIFYING COMPOUND | NIPPON SODA CO (JP) | 2016-11-02 | — | — | EP | disclosed |
| WO-2016142364-A1 | METHOD FOR PREPARATION OF CERTAIN 1,5 DISUBSTITUTED TETRAZOLES | LONZA LTD (CH) | 2016-09-15 | — | — | WO | disclosed |
| US-4892942-A | 1-CARBA (DETHIA)CEPHALOSPORINS | ELI LILLY AND COMPANY (US) | 1990-01-09 | — | — | US | disclosed |
| EP-0297448-A2 | Dyestuff mixtures containing isochinoline derivatives, their use in printing colours and isochinoline derivatives | BASF Aktiengesellschaft (DE) | 1989-01-04 | — | — | EP | disclosed |
| US-4791106-A | 1-Carbacephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1988-12-13 | — | — | US | disclosed |
| EP-0232623-A1 | 1-Carbacephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1987-08-19 | — | — | EP | disclosed |
| US-4532239-A | N-phenoxypropanol-N'-pyridazinyl ethylendiamines as β-receptor blockers | CASSELLA AKTIENGESELLSCHAFT (DE) | 1985-07-30 | — | — | US | disclosed |
| US-4496447-A | PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1985-01-29 | — | — | US | disclosed |
| EP-0054946-B1 | BASIC SUBSTITUTED PYRIDAZINES, THEIR PREPARATION AND THEIR USE | CASSELLA Aktiengesellschaft (DE) | 1984-08-15 | — | — | EP | disclosed |
| US-4374984-A | Aromatic-aliphatic ketones useful as photoinitiators | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1983-02-22 | — | — | US | disclosed |
| EP-0054946-A1 | Basic substituted pyridazines, their preparation and their use | CASSELLA Aktiengesellschaft (DE) | 1982-06-30 | — | — | EP | disclosed |
| US-4216314-A | CARDIOSELECTIVE B-ADRENOLYTIC AGENTS, ANTIARRHYTHMIC AGENTS AND HYPOTENSIVE AGENTS | CASSELLA FARBWERKE MAINKUR AKTIENGESELLSCHAFT (DE) | 1980-08-05 | — | — | US | disclosed |