⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7936208 | 0.80 | — | — | |
| SCHEMBL21450442 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL5428819 | 0.78 | MMP1 (0.36) | — | |
| SCHEMBL2811298 | 0.76 | FAAH (0.40) | — | |
| SCHEMBL20379712 | 0.76 | FAAH (0.40) | — | |
| SCHEMBL20379699 | 0.76 | — | — | |
| SCHEMBL15199703 | 0.76 | — | — | |
| SCHEMBL5174585 | 0.76 | ALOX15 (0.41) | — | |
| SCHEMBL27839076 | 0.74 | KMT2A (0.37) | — | |
| SCHEMBL5177522 | 0.74 | MMP1 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2215134-A2 | REDUCTION OF THE FORMATION OF BIOFILM BY MEANS OF MULTIFUNCTIONAL COPOLYMERS | Henkel AG & Co. KGaA (DE) | 2010-08-11 | — | — | EP | disclosed |
| WO-2009071451-A2 | REDUCTION OF THE FORMATION OF BIOFILM BY MEANS OF MULTIFUNCTIONAL COPOLYMERS | HENKEL AG & CO. KGAA (DE) | 2009-06-11 | — | — | WO | disclosed |