Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TRPM8 | Q7Z2W7 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| Butyl Chloride SCHEMBL11342425 | 0.88 | — | — | |
| Dichloropropane SCHEMBL28290577 | 0.85 | TSHR (0.69) | TSHRTDP1ALDH1A1LMNATHRB | |
| Butyl Chloride SCHEMBL11821096 | 0.84 | — | — | |
| SCHEMBL28162033 | 0.81 | TSHR (0.75) | TSHRTDP1ALDH1A1TRPM8LMNA | |
| Butyl Chloride SCHEMBL421 | 0.80 | — | — | |
| Butyl Chloride SCHEMBL3694160 | 0.80 | — | — | |
| Butyl Chloride SCHEMBL788825 | 0.80 | TSHR (1.00) | TSHRTDP1ALDH1A1LMNATHRB | |
| Butyl Chloride SCHEMBL10884696 | 0.79 | — | — | |
| Butyl Chloride SCHEMBL11224083 | 0.79 | — | — | |
| Butyl Chloride SCHEMBL6577890 | 0.79 | TSHR (0.69) | TSHRTDP1ALDH1A1TRPM8LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6420503-B1 | POLYCARBONS/OTHER/ | SUMITOMO BAKELITE CO. LTD. (JP) | 2002-07-16 | — | — | US | disclosed |
| US-4692555-A | Preparation of diphenolics | ETHYL CORPORATION (US) | 1987-09-08 | — | — | US | disclosed |