⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26747679 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL8501363 | 0.97 | GAA (0.32) | — | |
| SCHEMBL12691698 | 0.78 | CYP1A2 (0.30) | — | |
| SCHEMBL62851 | 0.77 | — | — | |
| SCHEMBL5268572 | 0.77 | — | — | |
| SCHEMBL62852 | 0.77 | — | — | |
| SCHEMBL164980 | 0.77 | — | — | |
| SCHEMBL7554601 | 0.77 | — | — | |
| SCHEMBL723877 | 0.77 | CYP2D6 (0.41) | — | |
| SCHEMBL7554026 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113195487-A | 2, 3-diaminosuccinyl conjugate linkers | 杭州多禧生物科技有限公司 | 2021-07-30 | — | — | CN | disclosed |
| US-6504046-B1 | Cyclization of nitriles using acids, to form oxazolinone chemical intermediates such as 2-phenyl-4-isopropyl-4-methyl-1,3-oxazol-5-one, used as fungicides | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 2003-01-07 | — | — | US | disclosed |
| EP-1092705-A1 | PROCESS FOR THE PREPARATION OF AMIDES | IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) | 2001-04-18 | — | — | EP | disclosed |
| US-6090815-A | Pyrimidinyloxyalkanoic amide derivatives and fungicides for agricultural and horticultural use | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2000-07-18 | — | — | US | disclosed |
| US-6054251-A | PHOTOCURING ACRYLIC RESIN HAVING (METH)ACRYLOYL GROUPS AS PHOTOSENSITIVE GROUPS AND GLYCIDYL GROUPS, AN INITIATOR CONTAINING TITANOCENE OF GIVEN FORMULA AND RADICAL PROTECTING COMPOUND OF N,N-DIMETHYLAMINO GROUPS BONDED TO AROMATIC RING | KANSAI PAINT CO., LTD. (JP) | 2000-04-25 | — | — | US | disclosed |
| EP-0940392-A1 | PYRIMIDINYLOXYALKANOIC AMIDE DERIVATIVES AND FUNGICIDES FOR AGRICULTURAL AND HORTICULTURAL USE | KumaiI Chemical Industry Co., Ltd. (JP) | 1999-09-08 | — | — | EP | disclosed |
| US-4503145-A | DIAGNOSIS OF LIVER DISORDERS | FUJI PHOTO FILM CO., LTD. (JP) | 1985-03-05 | — | — | US | disclosed |
| US-4494989-A | PRESSURE SENSITIVE CARBONLESS DUPLICATING OR THERMAL MARKING SYSTEMS | THE HILTON-DAVIS CHEMICAL CO. (US) | 1985-01-22 | — | — | US | disclosed |
| US-4478942-A | CATIONIC DYE BOUND TO ANIONIC POLYMER FOR ASSAY OF HYDROGEN PEROXIDE | FUJI PHOTO FILM CO., LTD. (JP) | 1984-10-23 | — | — | US | disclosed |
| US-4418037-A | PYROGALLOL DERIVATIVE STORAGE STABILIZER | FUJI PHOTO FILM CO., LTD. (JP) | 1983-11-29 | — | — | US | disclosed |
| US-4257954-A | INDOLYL-PHENYLSULFONYL-PHENYL METHANE | STERLING DRUG INC. (US) | 1981-03-24 | — | — | US | disclosed |