⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29167433 | 0.91 | TSHR (0.37) | — | |
| SCHEMBL11347136 | 0.81 | — | — | |
| SCHEMBL27263308 | 0.78 | — | — | |
| SCHEMBL7595957 | 0.77 | TSHR (0.31) | — | |
| SCHEMBL4002515 | 0.75 | ALDH1A1 (0.56) | — | |
| SCHEMBL11060536 | 0.75 | ALDH1A1 (0.56) | — | |
| SCHEMBL16474057 | 0.75 | — | — | |
| SCHEMBL24200 | 0.75 | — | — | |
| SCHEMBL7116374 | 0.75 | — | — | |
| SCHEMBL28307391 | 0.75 | ALDH1A1 (0.56) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4647675-A | Rhodamine dyes | BASF AKTIENGESELLSCHAFT (DE) | 1987-03-03 | — | — | US | claimed |
| EP-2900643-B1 | QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS | MERCK PATENT GMBH (DE) | 2017-09-27 | — | — | EP | disclosed |
| US-9388142-B2 | Quinazolinone derivatives as PARP inhibitors | MERCK PATENT GMBH (DE) | 2016-07-12 | — | — | US | disclosed |
| US-20150239850-A1 | QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS | MERCK PATENT GMBH (DE) | 2015-08-27 | — | — | US | disclosed |
| EP-2900643-A1 | QUINAZOLINONE DERIVATIVES AS PARP INHIBITORS | Merck Patent GmbH (DE) | 2015-08-05 | — | — | EP | disclosed |
| US-6743933-B2 | ALKOXYTITANIUM DERIVATIVES OF 1-(2-METHOXYETHOXY)-2,2,6,6-TETRAMETHYLHEPTANE-3,5-DIONE USED TO FORM STRONTIUM TITANATE, BARIUM TITANATE OR BARIUM STRONTIUM TITANATE THIN FILMS | ASAHI DENKA CO., LTD. (JP) | 2004-06-01 | — | — | US | disclosed |
| US-20030124251-A1 | Process of forming thin film and precursor for chemical vapor deposition | ASAHI DENKA CO., LTD. (JP) | 2003-07-03 | — | — | US | disclosed |
| CN-1420203-A | Method for mfg. thin film and feedstock for chemical vapor growth | ASANI DENKA KOGYO K K (JP) | 2003-05-28 | — | — | CN | disclosed |