⚠ 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 | |
|---|---|---|---|---|
| Boric Acid SCHEMBL28309962 | 0.89 | CA1 (0.56) | — | |
| SCHEMBL27480073 | 0.83 | ALDH1A1 (0.65) | — | |
| SCHEMBL18131682 | 0.80 | MAOA (0.58) | — | |
| Benzene SCHEMBL3440179 | 0.79 | ALDH1A1 (0.69) | — | |
| SCHEMBL62125 | 0.79 | ALDH1A1 (0.69) | — | |
| SCHEMBL9741303 | 0.79 | ALDH1A1 (0.69) | — | |
| SCHEMBL25403475 | 0.76 | ALDH1A1 (0.65) | — | |
| SCHEMBL3759913 | 0.76 | ALDH1A1 (0.65) | — | |
| Hydrogen Sulfide SCHEMBL5468201 | 0.76 | ALDH1A1 (0.65) | — | |
| SCHEMBL7899313 | 0.76 | ALDH1A1 (0.65) | — |
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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5811611-A | Method for producing monoalkenyl benzene | NIPPON OIL CO., LTD. (JP) | 1998-09-22 | — | — | US | claimed |
| EP-0133109-A1 | Process for the N doping of polymers | SOCIETE NATIONALE ELF AQUITAINE (FR) | 1985-02-13 | — | — | EP | claimed |
| CN-108348906-B | Hydrogenation catalyst composition and method for producing same, and hydrogenated polymer and method for producing same | 旭化成株式会社 | 2021-03-30 | — | — | CN | disclosed |
| EP-3381554-B1 | CATALYST COMPOSITION FOR HYDROGENATION, METHOD FOR PRODUCING SAME AND A METHOD FOR PRODUCING HYDROGENATED POLYMER | ASAHI CHEMICAL IND (JP) | 2021-02-17 | — | — | EP | disclosed |
| CN-106883361-B | A kind of the Janus nano material and its anionic polymerisation preparation method of chain-ball composite construction | 中国科学院化学研究所 | 2019-04-23 | — | — | CN | disclosed |
| US-20180345261-A1 | CATALYST COMPOSITION FOR HYDROGENATION, METHOD FOR PRODUCING SAME, HYDROGENATED POLYMER AND METHOD FOR PRODUCING SAME | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2018-12-06 | — | — | US | disclosed |
| US-10144004-B2 | Method for producing catalyst composition for hydrogenation and catalyst composition for hydrogenation | ASAHI KASEI CHEMICALS CORPORATION (JP) | 2018-12-04 | — | — | US | disclosed |
| EP-3381554-A1 | CATALYST COMPOSITION FOR HYDROGENATION, METHOD FOR PRODUCING SAME, HYDROGENATED POLYMER AND METHOD FOR PRODUCING HYDROGENATED POLYMER | Asahi Kasei Kabushiki Kaisha (JP) | 2018-10-03 | — | — | EP | disclosed |
| CN-108348906-A | Hydrogenation catalyst composition and method for producing same, and hydrogenated polymer and method for producing same | 旭化成株式会社 | 2018-07-31 | — | — | CN | disclosed |
| US-10016749-B2 | Catalyst composition for hydrogenation and method for hydrogenation using the same | ASAHI KASEI CHEMICALS CORPORATION (JP) | 2018-07-10 | — | — | US | disclosed |
| EP-2898949-B1 | HYDROGENATION CATALYST COMPOSITION AND HYDROGENATION METHOD USING SAID HYDROGENATION CATALYST COMPOSITION | ASAHI CHEMICAL IND (JP) | 2018-04-04 | — | — | EP | disclosed |
| EP-2898949-A1 | HYDROGENATION CATALYST COMPOSITION AND HYDROGENATION METHOD USING SAID HYDROGENATION CATALYST COMPOSITION | Asahi Kasei Chemicals Corporation (JP) | 2015-07-29 | — | — | EP | disclosed |
| CN-104736574-A | Method of producing hydrogenation catalyst composition and hydrogenation catalyst composition | ASAHI KASEI CHEMICALS CORP | 2015-06-24 | — | — | CN | disclosed |
| CN-104718026-A | Hydrogenation catalyst composition and hydrogenation method using said hydrogenation catalyst composition | ASAHI KASEI CHEMICALS CORP | 2015-06-17 | — | — | CN | disclosed |
| CN-104640629-A | Catalyst composition for hydrogenation and hydrogenation method using catalyst composition for hydrogenation | ASAHI KASEI CHEMICALS CORP | 2015-05-20 | — | — | CN | disclosed |
| EP-0789010-B1 | Method for producing monoalkenyl benzene | NIPPON OIL CO LTD (JP) | 1999-04-28 | — | — | EP | disclosed |
| US-5811611-A | Method for producing monoalkenyl benzene | NIPPON OIL CO., LTD. (JP) | 1998-09-22 | — | — | US | disclosed |
| EP-0644168-B1 | Method for producing monoalkenyl benzenes | NIPPON OIL CO LTD (JP) | 1998-07-15 | — | — | EP | disclosed |
| EP-0789010-A1 | Method for producing monoalkenyl benzene | NIPPON OIL CO. LTD. (JP) | 1997-08-13 | — | — | EP | disclosed |
| EP-0644168-A1 | Method for producing monoalkenyl benzenes | NIPPON OIL CO. LTD. (JP) | 1995-03-22 | — | — | EP | disclosed |