Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TLR4 | O00206 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11154305 | 1.00 | ESR2 (0.38) | ESR2GAAMAPTTLR4CYP1A2 | |
| SCHEMBL10892615 | 0.93 | ESR2 (0.34) | ESR2GAAMAPTMEN1KMT2A | |
| SCHEMBL10892623 | 0.93 | ESR2 (0.34) | ESR2GAAMAPTMEN1KMT2A | |
| SCHEMBL10893450 | 0.93 | ESR2 (0.34) | ESR2GAAMAPTTLR4 | |
| SCHEMBL11128639 | 0.93 | DRD2 (0.34) | ESR2GAAMAPTTLR4MEN1 | |
| SCHEMBL11128636 | 0.93 | DRD2 (0.34) | ESR2GAAMAPTTLR4MEN1 | |
| Fluoride SCHEMBL9841265 | 0.92 | ESR2 (0.33) | ESR2GAAMAPTTLR4CYP1A2 | |
| SCHEMBL18472189 | 0.91 | LSS (0.36) | ESR2GAAMAPT | |
| SCHEMBL10894133 | 0.91 | HRH3 (0.39) | MAPTMEN1KMT2ANPC1RAB9A | |
| Fluoride SCHEMBL9841615 | 0.91 | GAA (0.34) | ESR2GAAMAPTCYP1A2MEN1 |
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-4477369-A | New high temperature liquid-crystalline substances consisting of 4 or 5 six-member-rings and liquid-crystalline compositions containing same | CHISSO CORPORATION (JP) | 1984-10-16 | — | — | US | disclosed |
| EP-0084974-A1 | Carbocyclic compounds with liquid-crystal properties | Chisso Corporation (JP) | 1983-08-03 | — | — | EP | disclosed |