⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1236327 | 0.83 | — | — | |
| SCHEMBL1744488 | 0.81 | APP (0.44) | — | |
| SCHEMBL13863427 | 0.75 | LMNA (0.45) | — | |
| 2,2'-Dithiodiethanesulfonic Acid SCHEMBL773704 | 0.75 | PTGS1 (0.45) | — | |
| 2,2'-Dithiodiethanesulfonic Acid SCHEMBL8403166 | 0.73 | PTGS1 (0.43) | — | |
| 2,2'-Dithiodiethanesulfonic Acid SCHEMBL747638 | 0.73 | PTGS1 (0.43) | — | |
| 2,2'-Dithiodiethanesulfonic Acid SCHEMBL7864315 | 0.73 | PTGS1 (0.43) | — | |
| 2,2'-Dithiodiethanesulfonic Acid SCHEMBL836069 | 0.73 | PTGS1 (0.43) | — | |
| SCHEMBL751071 | 0.73 | LMNA (0.43) | — | |
| 2,2'-Dithiodiethanesulfonic Acid SCHEMBL32679299 | 0.73 | PTGS1 (0.43) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8642659-B2 | Hair treatment product and hair after-treatment product containing ether guanidines as active substances, for protecting from damage caused by chemical treatment and for repairing already damaged hair | EVONIK GOLDSCHMIDT GMBH (DE) | 2014-02-04 | — | — | US | disclosed |
| US-20110117219-A1 | HAIR TREATMENT PRODUCT AND HAIR AFTER-TREATMENT PRODUCT CONTAINING ETHER GUANIDINES AS ACTIVE SUBSTANCES, FOR PROTECTING FROM DAMAGE CAUSED BY CHEMICAL TREATMENT AND FOR REPAIRING ALREADY DAMAGED HAIR | EVONIK GOLDSCHMIDT GMBH (DE) | 2011-05-19 | — | — | US | disclosed |
| WO-2009022430-A1 | SKIN WHITENING AGENT | KI PHARMACEUTICALS, INC. (JP) | 2009-02-19 | — | — | WO | disclosed |
| US-5242772-A | Process for the production of a lithographic printing plate of direct image type | FUJI PHOTO FILM CO., LTD. (JP) | 1993-09-07 | — | — | US | disclosed |