⚠ 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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL5317556 | 0.76 | — | — | |
| Sulfuric Acid SCHEMBL28793230 | 0.74 | ALDH1A1 (0.42) | — | |
| SCHEMBL9487544 | 0.74 | — | — | |
| SCHEMBL9542021 | 0.73 | TSHR (0.31) | — | |
| SCHEMBL8788202 | 0.73 | TSHR (0.31) | — | |
| SCHEMBL177879 | 0.73 | LMNA (0.35) | — | |
| SCHEMBL6659756 | 0.71 | LMNA (0.30) | — | |
| SCHEMBL27870488 | 0.70 | CA5A (0.32) | — | |
| SCHEMBL27619124 | 0.70 | — | — | |
| SCHEMBL8325255 | 0.70 | ALDH1A1 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015034488-A1 | HYDROLYZABLE COMPOUNDS FOR TREATMENT OF A SUBTERRANEAN FORMATION AND METHODS OF USING THE SAME | HALLIBURTON ENERGY SERVICES, INC. (US) | 2015-03-12 | — | — | WO | claimed |
| WO-2015034488-A1 | HYDROLYZABLE COMPOUNDS FOR TREATMENT OF A SUBTERRANEAN FORMATION AND METHODS OF USING THE SAME | HALLIBURTON ENERGY SERVICES, INC. (US) | 2015-03-12 | — | — | WO | disclosed |