⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1052068 | 0.90 | — | — | |
| SCHEMBL17799153 | 0.71 | — | — | |
| SCHEMBL31164819 | 0.69 | TRIM24 (0.36) | — | |
| SCHEMBL23630990 | 0.69 | — | — | |
| SCHEMBL14163832 | 0.69 | TRIM24 (0.36) | — | |
| SCHEMBL18106216 | 0.62 | — | — | |
| SCHEMBL1976377 | 0.62 | — | — | |
| SCHEMBL8040162 | 0.62 | — | — | |
| SCHEMBL10999359 | 0.62 | — | — | |
| SCHEMBL6662387 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4073785-A | Certain as-triazino 4,3-a! 1,4!benzodiazepine derivatives | THE UPJOHN COMPANY (US) | 1978-02-14 | — | — | US | claimed |
| US-8288077-B2 | Chemically amplified resist composition and salt employed therein | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-10-16 | — | — | US | disclosed |
| CN-101443006-B | Novel benzylamine derivatives as CETP inhibitors | REDDY US THERAPEUTICS INC | 2012-10-10 | — | — | CN | disclosed |
| US-20110020749-A1 | CHEMICALLY AMPLIFIED RESIST COMPOSITION AND SALT EMPLOYED THEREIN | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-01-27 | — | — | US | disclosed |
| US-20050256184-A1 | 1,2,4-Trioxanes and 1,2,4-trioxepanes | O'NEILL PAUL M | 2005-11-17 | — | — | US | disclosed |
| EP-1286981-A1 | METHOD FOR THE PRODUCTION OF 2- COUMARONE AND SUBSTITUTED 2-COUMARONES | DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) | 2003-03-05 | — | — | EP | disclosed |
| WO-2001094329-A1 | METHOD FOR THE PRODUCTION OF 2- COUMARONE AND SUBSTITUTED 2-COUMARONES | DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) | 2001-12-13 | — | — | WO | disclosed |
| EP-0818451-B1 | Process for the preparation of the enollactone of the 2-oxocyclohexylidene acetic acid and use for the preparation of the 2-coumaranone | CLARIANT FRANCE SA (FR) | 2001-06-13 | — | — | EP | disclosed |
| EP-0818451-B1 | Process for the preparation of the enollactone of the 2-oxocyclohexylidene acetic acid and use for the preparation of the 2-coumaranone | CLARIANT FRANCE SA (FR) | 2001-06-13 | — | — | EP | disclosed |
| EP-0818451-A1 | Process for the preparation of the enollactone of the 2-oxocyclohexylidene acetic acid and use for the preparation of the 2-coumaranone | Clariant Chimie S.A. (FR) | 1998-01-14 | — | — | EP | disclosed |
| EP-0818451-A1 | Process for the preparation of the enollactone of the 2-oxocyclohexylidene acetic acid and use for the preparation of the 2-coumaranone | Clariant Chimie S.A. (FR) | 1998-01-14 | — | — | EP | disclosed |
| US-4073785-A | Certain as-triazino 4,3-a! 1,4!benzodiazepine derivatives | THE UPJOHN COMPANY (US) | 1978-02-14 | — | — | US | disclosed |