SCHEMBL30322751

SCHEMBL30322751

COc1cccc(COc2ccccc2C(=O)Nc2cccnc2)c1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 6/20 0.76
SGMS2 Q8NHU3 14/20 0.74

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
SCHEMBL17551877 1.00 LRRK2 (0.76) LRRK2SGMS2
SCHEMBL15943337 0.89 LRRK2 (0.78) LRRK2SGMS2
SCHEMBL17551782 0.89 SGMS2 (0.79) LRRK2SGMS2
SCHEMBL30322886 0.89 SGMS2 (0.79) LRRK2SGMS2
SCHEMBL1646763 0.88 LRRK2 (0.82) LRRK2SGMS2
SCHEMBL17551826 0.88 SGMS2 (0.75) LRRK2SGMS2
SCHEMBL30322760 0.88 SGMS2 (0.78) LRRK2SGMS2
SCHEMBL17551776 0.88 SGMS2 (0.78) LRRK2SGMS2
SCHEMBL1647152 0.87 LRRK2 (1.00) LRRK2SGMS2
SCHEMBL17551832 0.86 SGMS2 (0.66) LRRK2SGMS2

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
EP-3196191-B1 2-ALKYLOXY BENZENE FORMYL ARYLAMINE COMPOUND AND PHARMACEUTICAL USE THEREOF UNIV FUDAN (CN) 2023-04-19 EP disclosed