⚠ 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 | |
|---|---|---|---|---|
| Chloroform SCHEMBL27708536 | 1.00 | ALDH1A1 (0.40) | — | |
| Chloroform SCHEMBL27652357 | 0.96 | ALDH1A1 (0.38) | — | |
| Chloroform SCHEMBL181824 | 0.91 | — | — | |
| Chloroform SCHEMBL9236775 | 0.91 | ALDH1A1 (0.46) | — | |
| Chloroform SCHEMBL613360 | 0.91 | — | — | |
| Chloroform SCHEMBL7827442 | 0.91 | ALDH1A1 (0.46) | — | |
| Chloroform SCHEMBL9230061 | 0.91 | ALDH1A1 (0.46) | — | |
| Acetonitrile SCHEMBL8043043 | 0.88 | — | — | |
| Isopropyl Alcohol SCHEMBL10462689 | 0.85 | ALDH1A1 (0.43) | — | |
| Acetic Acid SCHEMBL28050752 | 0.84 | FFAR3 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106305785-B | It is a kind of to improve the composite bacteria agent of content beta-carotene and its application in carrot | 青岛科拓恒通乳酸菌产业化开发研究院有限公司 | 2018-10-02 | — | — | CN | disclosed |
| CN-106305785-A | Composite inoculant capable of increasing content of beta-carotene in carrots | 青岛科拓恒通乳酸菌产业化开发研究院有限公司 | 2017-01-11 | — | — | CN | disclosed |
| CN-100396675-C | Prodrugs of proton pump inhibitors | PARTNERSHIP OF MICHAEL E GAST (US) | 2008-06-25 | — | — | CN | disclosed |
| CN-1517124-A | Chinese medicinal composition with antipyretic effect, and its preparation method and quality control method | 江苏康缘药业股份有限公司 | 2004-08-04 | — | — | CN | disclosed |
| US-6559167-B1 | Prodrugs of the pyridyl methyl sulfinyl benzimidazole type proton pump inhibitor drugs have a hydrolyzable arylsulfonyl or heteroarylsulfonyl group attached to the benzimidazole nitrogen. The prodrugs of the invention hydrolyze under | REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2003-05-06 | — | — | US | disclosed |
| EP-1105387-B1 | PRODRUGS OF PROTON PUMP INHIBITORS | WINSTON PHARMATEUTICALS LLC (US) | 2003-01-29 | — | — | EP | disclosed |
| CN-1312806-A | Prodrugs of proton pump inhibitors | PARTNERSHIP OF MICHAEL E GAST (US) | 2001-09-12 | — | — | CN | disclosed |
| WO-1998003181-A1 | POLYSULFOLITHOCOLIC ACIDS AS GROWTH FACTOR RECEPTOR INHIBITORS | TEXAS BIOTECHNOLOGY CORPORATION (US) | 1998-01-29 | — | — | WO | disclosed |