SCHEMBL20443236

SCHEMBL20443236

Cc1cc(B2OC(C)(C)C(C)(C)O2)c2ccn(SI)c2n1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.31

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL21361812 0.84 SNCA (0.31)
SCHEMBL20443312 0.83 IRAK4 (0.32) IRAK4
SCHEMBL20443037 0.82
SCHEMBL26043592 0.81 IRAK4 (0.33) IRAK4
SCHEMBL20759578 0.79
SCHEMBL20443212 0.78 IRAK4 (0.31) IRAK4
SCHEMBL20930355 0.77 ABL1 (0.35)
SCHEMBL25364980 0.76 KDM4E (0.33) IRAK4
SCHEMBL26720584 0.72 L3MBTL1 (0.44)
SCHEMBL20651743 0.71

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018137655-A1 PYRROLO-PYRIDINES N-OXIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 江苏豪森药业集团有限公司 2018-08-02 WO disclosed