⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4003136 | 0.76 | ALDH1A1 (0.41) | — | |
| SCHEMBL4003140 | 0.73 | — | — | |
| SCHEMBL11015656 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL27777457 | 0.71 | — | — | |
| SCHEMBL28019073 | 0.71 | — | — | |
| SCHEMBL28261871 | 0.71 | — | — | |
| SCHEMBL27621101 | 0.69 | — | — | |
| SCHEMBL28581761 | 0.69 | ALDH1A1 (0.35) | — | |
| SCHEMBL28578582 | 0.69 | ALDH1A1 (0.35) | — | |
| SCHEMBL27708428 | 0.69 | — | — |
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-102844299-B | Desinsection aryl-pyrrolidine alkane | BAYER CROPSCIENCE AG (DE) | 2016-03-30 | — | — | CN | disclosed |
| CN-104204037-A | Polyamide acid and resin composition containing same | TORAY INDUSTRIES | 2014-12-10 | — | — | CN | disclosed |
| US-8536172-B2 | Inhibitors of JNK | ROCHE PALO ALTO LLC (US) | 2013-09-17 | — | — | US | disclosed |
| US-8536172-B2 | Inhibitors of JNK | ROCHE PALO ALTO LLC (US) | 2013-09-17 | — | — | US | disclosed |
| CN-102844299-A | Pesticidal arylpyrrolidines | BAYER CROPSCIENCE AG | 2012-12-26 | — | — | CN | disclosed |
| WO-2011018417-A1 | INHIBITORS OF JNK | F. HOFFMANN-LA ROCHE AG (CH) | 2011-02-17 | — | — | WO | disclosed |
| US-20110034470-A1 | Inhibitors of JNK | GONG LEYI | 2011-02-10 | — | — | US | disclosed |
| US-20110034470-A1 | Inhibitors of JNK | GONG LEYI | 2011-02-10 | — | — | US | disclosed |
| EP-0287042-B1 | 2-SULPHINYL-ACETYL-1,3-THIAZOLIDINES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1992-09-16 | — | — | EP | disclosed |
| US-4849437-A | 2-sulphinyl-acetyl-1,3-thiazolidines, their preparation and pharmaceutical compositions | BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) | 1989-07-18 | — | — | US | disclosed |
| EP-0287042-A1 | 2-Sulphinyl-acetyl-1,3-thiazolidines, their preparation and pharmaceutical compositions | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1988-10-19 | — | — | EP | disclosed |
| EP-0107570-B1 | CYCLOPROPANECARBOXYLIC-ACID DERIVATIVES SUBSTITUTED AT POSITION 3 BY A SUBSTITUTED VINYL GROUP, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE AS PESTICIDES AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1986-01-15 | — | — | EP | disclosed |
| EP-0107570-A1 | Cyclopropanecarboxylic-acid derivatives substituted at position 3 by a substituted vinyl group, process and intermediates for their preparation, their use as pesticides and compositions containing them | ROUSSEL-UCLAF (FR) | 1984-05-02 | — | — | EP | disclosed |