⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9153485 | 0.79 | TSHR (0.40) | — | |
| SCHEMBL641736 | 0.79 | — | — | |
| SCHEMBL29187298 | 0.79 | TSHR (0.40) | — | |
| SCHEMBL9154922 | 0.75 | — | — | |
| SCHEMBL20369085 | 0.75 | TSHR (0.42) | — | |
| SCHEMBL20364824 | 0.75 | TSHR (0.37) | — | |
| SCHEMBL12703256 | 0.75 | TSHR (0.37) | — | |
| SCHEMBL27989256 | 0.75 | — | — | |
| SCHEMBL18074929 | 0.75 | TSHR (0.37) | — | |
| SCHEMBL16768602 | 0.75 | TSHR (0.37) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5504248-A | Preparation of halogenated compounds | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-04-02 | — | — | US | claimed |
| CN-105008375-B | Tetrahydroimidazo [1,5-d ] [1,4] oxazepine derivatives | 卫材R&D管理有限公司 | 2016-12-28 | — | — | CN | disclosed |
| CN-105008375-A | Tetrahydroimidazo [1,5-d ] [1,4] oxazepine derivatives | WEI CAIR | 2015-10-28 | — | — | CN | disclosed |
| US-20030130123-A1 | 2-Phenyl-2h-pyridazine-3-ones | BASF AKTIENGESELLSCHAFT (DE) | 2003-07-10 | — | — | US | disclosed |
| EP-1272476-A1 | 2-PHENYL-2H-PYRIDAZINE-3-ONES | BASF AKTIENGESELLSCHAFT (DE) | 2003-01-08 | — | — | EP | disclosed |
| WO-2001079183-A1 | 2-PHENYL-2H-PYRIDAZINE-3-ONES | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-25 | — | — | WO | disclosed |
| US-5504248-A | Preparation of halogenated compounds | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-04-02 | — | — | US | disclosed |
| US-4900823-A | PHOTOINITIATORS FOR PHOTOCURING | CIBA-GEIGY CORPORATION (US) | 1990-02-13 | — | — | US | disclosed |
| US-4739052-A | PHOTOINITIATORS | CIBA-GEIGY CORPORATION (US) | 1988-04-19 | — | — | US | disclosed |
| US-4582862-A | QUICK-SETTING PRINTING INKS BASED ON ACRYLATED RESINS | CIBA-GEIGY CORPORATION (US) | 1986-04-15 | — | — | US | disclosed |
| US-4559371-A | FOR PRINTING INKS AND PAINTS | CIBA GEIGY CORPORATION (US) | 1985-12-17 | — | — | US | disclosed |
| EP-0117233-A1 | Coloured photo-curable mouldings | CIBA-GEIGY AG (CH) | 1984-08-29 | — | — | EP | disclosed |
| EP-0088050-A2 | Coloured photo-hardenable composition | CIBA-GEIGY AG (CH) | 1983-09-07 | — | — | EP | disclosed |