⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11804668 | 0.69 | — | — | |
| SCHEMBL17825599 | 0.69 | — | — | |
| SCHEMBL94871 | 0.67 | — | — | |
| SCHEMBL794633 | 0.64 | — | — | |
| SCHEMBL7128697 | 0.64 | — | — | |
| SCHEMBL5734251 | 0.64 | — | — | |
| SCHEMBL3559235 | 0.64 | — | — | |
| SCHEMBL10395562 | 0.64 | NFKB1 (0.40) | — | |
| SCHEMBL725060 | 0.64 | — | — | |
| SCHEMBL11507765 | 0.64 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4173489-A | Asphalt mineral aggregate compositions | TEXACO INC. (US) | 1979-11-06 | — | — | US | disclosed |
| US-4170484-A | Bituminous-emulsion mineral aggregate compositions | TEXACO INC. (US) | 1979-10-09 | — | — | US | disclosed |
| US-4038096-A | BITUMINOUS EMULSION-MINERAL AGGREGATE COMPOSITIONS CONTAINING SILANES AS ADHESION PROMOTERS | CHEVRON RESEARCH COMPANY (US) | 1977-07-26 | — | — | US | disclosed |
| US-4036661-A | AMINOALKYL POLYALKOXYSILANES | CHEVRON RESEARCH COMPANY (US) | 1977-07-19 | — | — | US | disclosed |