⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8619563 | 0.63 | MAPK1 (0.34) | — | |
| SCHEMBL168692 | 0.61 | MAPK1 (0.36) | — | |
| SCHEMBL30174146 | 0.61 | — | — | |
| SCHEMBL8502136 | 0.55 | — | — | |
| SCHEMBL8693530 | 0.51 | — | — | |
| SCHEMBL8841260 | 0.46 | TP53 (0.35) | — | |
| SCHEMBL2344957 | 0.46 | — | — | |
| SCHEMBL633176 | 0.45 | MAPK1 (0.40) | — | |
| SCHEMBL11549023 | 0.45 | TP53 (0.30) | — | |
| SCHEMBL6520826 | 0.43 | ALOX15 (0.32) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108840994-A | A kind of synthetic method containing α-D-MANNOSE and β-D-Glucose random copolymer | 上海应用技术大学 | 2018-11-20 | — | — | CN | disclosed |
| US-6281307-B1 | METATHESIS POLYMERIZATION | CIBA SPECIALTY CHEMICALS CORPORATION | 2001-08-28 | — | — | US | disclosed |
| EP-0608132-B1 | Coating varnish composition and antifouling coating composition | HITACHI CHEMICAL CO LTD (JP) | 1998-05-20 | — | — | EP | disclosed |
| US-5646198-A | MIXTURE INCLUDES POLYMER, BENZOTRIAZOLE OR TRIAZOLE COMPOUND, AND COMPOUND WITH HYDROPHOBIC AND HYDROPHILIC PARTS; STORAGE STABILITY; MARINE STRUCTURES | HITACHI CHEMICAL COMPANY, LTD. (JP) | 1997-07-08 | — | — | US | disclosed |
| US-5439511-A | Composition containing polymer obtained by polymerizing unsaturated acid anhydride and another unsaturated compound, specified additive | HITACHI CHEMICAL COMPANY, LTD. (JP) | 1995-08-08 | — | — | US | disclosed |
| EP-0659848-A2 | Coating composition and antifouling paint | Hitachi Chemical Co., Ltd. (JP) | 1995-06-28 | — | — | EP | disclosed |
| EP-0608132-A1 | Coating varnish composition and antifouling coating composition | HITACHI CHEMICAL CO., LTD. (JP) | 1994-07-27 | — | — | EP | disclosed |