⚠ 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 | |
|---|---|---|---|---|
| Methanesulfonic Acid Methyl Ester SCHEMBL63290 | 0.91 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL573583 | 0.91 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL16060132 | 0.91 | USP2 (1.00) | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL28884811 | 0.87 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL28791572 | 0.87 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL30084031 | 0.87 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL5666257 | 0.87 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL28902358 | 0.87 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL30823732 | 0.87 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL27716788 | 0.87 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109942550-A | 11EGFR positive electron tracer of C flag and its preparation method and application | 广州医科大学附属第一医院（广州呼吸中心） | 2019-06-28 | — | — | CN | claimed |
| CN-107275675-A | A kind of nonaqueous lithium ion battery electrolyte and lithium ion battery | 珠海市赛纬电子材料股份有限公司 | 2017-10-20 | — | — | CN | claimed |
| CN-109776419-A | Sulfosalt and its preparation method and application containing pyrazoline group | 同济大学 | 2019-05-21 | — | — | CN | disclosed |
| CN-105611948-B | For the diagnosticum for the treatment of of cancer effect | 浜松光子学株式会社 | 2018-12-18 | — | — | CN | disclosed |
| CN-108137545-A | TRIAZOLE AGONISTS OF THE APJ RECEPTOR | 美国安进公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-104238268-B | Sulfosalt class photo-acid agent based on triphenylethylene, preparation method and applications | 同济大学 | 2017-12-26 | — | — | CN | disclosed |
| CN-105712917-B | Conjugated type sulfosalt light trigger, preparation method and applications with light trigger and photosensitizer dual-use function | 同济大学 | 2017-12-26 | — | — | CN | disclosed |
| CN-107318898-A | A kind of peach fast distribution type vegetable soda insecticidal dust and preparation method thereof | 徐州市贾汪区信守农业发展有限公司 | 2017-11-07 | — | — | CN | disclosed |
| CN-101208344-B | (R) -N-methylnaltrexone, method for the synthesis thereof and pharmaceutical use thereof | PROGENICS PHARM INC | 2012-10-24 | — | — | CN | disclosed |
| CN-102721756-A | Synthesis of (R)-N-methylnaltrexone | PROGENICS PHARM INC | 2012-10-10 | — | — | CN | disclosed |
| CN-101678016-A | N-oxides of 4, 5-epoxy-morphinanium analogs | PROGENICS PHARM INC | 2010-03-24 | — | — | CN | disclosed |
| CN-101636160-A | (R) -N-stereoisomers of 7, 8-saturated-4, 5-epoxy-morphinanium analogs | PROGENICS PHARM INC | 2010-01-27 | — | — | CN | disclosed |
| CN-101208344-A | (R) -N-methylnaltrexone, method for the synthesis thereof and pharmaceutical use thereof | PROGENICS PHARM INC (US) | 2008-06-25 | — | — | CN | disclosed |