⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17519118 | 0.67 | — | — | |
| SCHEMBL4520004 | 0.61 | — | — | |
| SCHEMBL9901675 | 0.61 | — | — | |
| SCHEMBL356086 | 0.61 | — | — | |
| SCHEMBL6519554 | 0.55 | — | — | |
| SCHEMBL6519556 | 0.55 | — | — | |
| Ethylene SCHEMBL9212488 | 0.55 | — | — | |
| Ethylene SCHEMBL7624355 | 0.55 | — | — | |
| SCHEMBL2039479 | 0.50 | — | — | |
| SCHEMBL490942 | 0.50 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103298853-B | Reactive functional group-modified molecularly self-assembling material | DOW GLOBAL TECHNOLOGIES INC | 2015-06-24 | — | — | CN | disclosed |
| US-8697375-B2 | In vivo biofilm infection diagnosis and treatment | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2014-04-15 | — | — | US | disclosed |
| CN-103298853-A | Reactive functional group-modified molecularly self-assembling material | DOW GLOBAL TECHNOLOGIES INC | 2013-09-11 | — | — | CN | disclosed |
| US-20110171123-A1 | In Vivo Biofilm Infection Diagnosis and Treatment | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2011-07-14 | — | — | US | disclosed |
| EP-2335073-A2 | IN VIVO BIOFILM INFECTION DIAGNOSIS AND TREATMENT | University of Maryland Baltimore (US) | 2011-06-22 | — | — | EP | disclosed |
| WO-2010028013-A2 | IN VIVO BIOFILM INFECTION DIAGNOSIS AND TREATMENT | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2010-03-11 | — | — | WO | disclosed |