Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL16183587 | 0.76 | LPL (0.33) | — | |
| SCHEMBL13868359 | 0.72 | KDM4E (0.33) | ESR2 | |
| SCHEMBL13868347 | 0.72 | ESR2 (0.35) | ESR2 | |
| SCHEMBL16110234 | 0.69 | ESR2 (0.31) | ESR2 | |
| SCHEMBL17398825 | 0.69 | P4HB (0.30) | CYP2A6 | |
| SCHEMBL27191802 | 0.69 | ESR2 (0.31) | ESR2 | |
| SCHEMBL16815883 | 0.68 | ESR2 (0.36) | ESR2 | |
| SCHEMBL13868346 | 0.68 | ESR2 (0.33) | ESR2CYP2A6 | |
| SCHEMBL1495731 | 0.68 | ESR2 (0.33) | ESR2CYP2A6 | |
| SCHEMBL31711055 | 0.68 | P2RX7 (0.32) | ESR2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7514563-B2 | Producing cyano-substituted pyridine, pyrrole, furan, thiophene or benzene boranes by reacting a cyanoarene with a BH or a HBBH compound, especially 4,4,5,5-tetramethyl-1,3,2-dioxborolane or its dimer, in the presence of an organo-phosphorus or -nitrogen iridium complex; drug intermediates | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) | 2009-04-07 | — | — | US | disclosed |