⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21359710 | 1.00 | — | — | |
| SCHEMBL27808156 | 0.96 | CA1 (0.31) | — | |
| SCHEMBL21049480 | 0.96 | CA1 (0.31) | — | |
| SCHEMBL6518481 | 0.96 | CA1 (0.31) | — | |
| SCHEMBL2260494 | 0.96 | CA1 (0.31) | — | |
| SCHEMBL10888853 | 0.96 | CA1 (0.31) | — | |
| SCHEMBL677858 | 0.96 | CA1 (0.31) | — | |
| SCHEMBL6826969 | 0.96 | CA1 (0.31) | — | |
| SCHEMBL27890520 | 0.93 | SOAT1 (0.30) | — | |
| SCHEMBL20588030 | 0.92 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100333772-C | Medicine for treating digestive tract ulcer and stomach cercinoma prophase pathologic change | JIANG YINGCHUN (CN) | 2007-08-29 | — | — | CN | disclosed |
| CN-1682878-A | Medicine for treating digestive tract ulcer and stomach cercinoma prophase pathologic change | JIANG YINGCHUN (CN) | 2005-10-19 | — | — | CN | disclosed |
| US-6121213-A | STABILIZED AGAINST CHEMICAL DEGRADATION BY A COMBINATION OF A BICARBONATE AND A PHOSPHATE | BLOCK DRUG COMPANY, INC. (US) | 2000-09-19 | — | — | US | disclosed |