⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL647388 | 0.74 | — | — | |
| SCHEMBL7736487 | 0.70 | — | — | |
| SCHEMBL6202651 | 0.70 | — | — | |
| Methyl Alcohol SCHEMBL7505062 | 0.63 | — | — | |
| SCHEMBL30558301 | 0.60 | TDP1 (0.38) | — | |
| SCHEMBL486997 | 0.59 | — | — | |
| SCHEMBL20474 | 0.59 | — | — | |
| SCHEMBL7801798 | 0.59 | — | — | |
| SCHEMBL6337059 | 0.59 | — | — | |
| SCHEMBL194859 | 0.59 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104136451-A | Synthesis and use of nucleic acid compounds with conformationally constrained monomers | MARINA BIOTECH INC | 2014-11-05 | — | — | CN | disclosed |
| CN-103402987-A | 6-Amino-2-phenylamino-1H-benzimidazole-5-carboxamide derivatives and their use as microsomal prostaglandin E2 synthase-1 inhibitors | BOEHRINGER INGELHEIM INT | 2013-11-20 | — | — | CN | disclosed |
| CN-103097359-A | Novel compounds | BOEHRINGER INGELHEIM INT | 2013-05-08 | — | — | CN | disclosed |
| WO-2007025940-A1 | SUBSTITUTED BIARYLS AND THEIR USE AS FACTOR XA INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-03-08 | — | — | WO | disclosed |
| CN-1688509-A | Filled silicone compositions and cured silicone products | DOW CORNING (US) | 2005-10-26 | — | — | CN | disclosed |
| US-6407041-B1 | HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-06-18 | — | — | US | disclosed |
| EP-1037882-A1 | SUBSTITUTED 2,4-DIAMINO-1,3,5-TRIAZINES | BAYER AG (DE) | 2000-09-27 | — | — | EP | disclosed |
| WO-1999029677-A1 | SUBSTITUTED 2,4-DIAMINO-1,3,5-TRIAZINES | BAYER AKTIENGESELLSCHAFT (DE) | 1999-06-17 | — | — | WO | disclosed |
| WO-1999019309-A1 | SUBSTITUTED 2,4-DIAMINO-1,3,5-TRIAZINES | BAYER AKTIENGESELLSCHAFT (DE) | 1999-04-22 | — | — | WO | disclosed |
| US-3996285-A | 1-(N-dihydroxyalkyl) aminoalkylene-2-propenyl substituted hydrocarbons | ETHYL CORPORATION | 1976-12-07 | — | — | US | disclosed |
| US-3996285-A | 1-(N-dihydroxyalkyl) aminoalkylene-2-propenyl substituted hydrocarbons | ETHYL CORPORATION | 1976-12-07 | — | — | US | disclosed |
| US-3960865-A | Mono or bis 3-(polypropyl or butyl-propenyl)-amino alkyl piperazines | STANDARD OIL COMPANY (US) | 1976-06-01 | — | — | US | disclosed |
| US-3960865-A | Mono or bis 3-(polypropyl or butyl-propenyl)-amino alkyl piperazines | STANDARD OIL COMPANY (US) | 1976-06-01 | — | — | US | disclosed |
| US-3950426-A | 1-Amino-2-propenyl and 1-amino-2-methylpropenyl alkane hydrocarbon | STANDARD OIL COMPANY (US) | 1976-04-13 | — | — | US | disclosed |
| US-3950426-A | 1-Amino-2-propenyl and 1-amino-2-methylpropenyl alkane hydrocarbon | STANDARD OIL COMPANY (US) | 1976-04-13 | — | — | US | disclosed |
| US-3936462-A | CNS DEPRESSANT, ANALGESIC | STERLING DRUG INC. (US) | 1976-02-03 | — | — | US | disclosed |