SCHEMBL20652181

SCHEMBL20652181

CSOCC(F)CNc1nc(Cl)ncc1Cl

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 0.39
STK17A Q9UEE5 1/20 0.39
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ABL1 P00519 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL20652182 0.80 STK17B (0.40) STK17BSTK17AALDH1A1L3MBTL1
SCHEMBL20640564 0.77 ALDH1A1 (0.41) STK17BSTK17AALDH1A1L3MBTL1
SCHEMBL20652230 0.77 STK17A (0.42) STK17BSTK17AALDH1A1L3MBTL1
SCHEMBL1935123 0.77 ALDH1A1 (0.41) STK17BSTK17AALDH1A1L3MBTL1
SCHEMBL1937307 0.74 ESR1 (0.49) STK17BSTK17AALDH1A1L3MBTL1
SCHEMBL1937173 0.70 STK17A (0.41) STK17BSTK17AALDH1A1L3MBTL1
SCHEMBL20652190 0.69 CRHR1 (0.36) STK17BSTK17A
SCHEMBL1935303 0.68 STK17B (0.47) STK17BSTK17AALDH1A1L3MBTL1
SCHEMBL1934538 0.66 STK17A (0.51) STK17BSTK17AALDH1A1L3MBTL1
SCHEMBL1938676 0.65 STK17A (0.51) STK17BSTK17AALDH1A1

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-2019012093-A1 INHIBITORS OF LEUCINE RICH REPEAT KINASE 2 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-17 WO disclosed