SCHEMBL15920456

SCHEMBL15920456

Cc1cc(NC(C)(C)COS(C)(=O)=O)nc(C)n1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.39
▸ AGO2 Q9UKV8 1/20 0.39
▸ ALDH1A1 P00352 6/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ USP2 O75604 1/20 0.37
▸ POLB P06746 3/20 0.35
▸ MAPT P10636 1/20 0.35
▸ GFER P55789 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ ALOX15 P16050 1/20 0.34

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
SCHEMBL15901038 0.76 ATF1 (0.32) —
SCHEMBL26538070 0.75 MAPT (0.41) PDE4AAGO2ALDH1A1KDM4ELMNA
SCHEMBL20355508 0.73 POLB (0.38) PDE4AAGO2ALDH1A1KDM4ELMNA
SCHEMBL12883359 0.70 POLB (0.43) PDE4AAGO2ALDH1A1KDM4ELMNA
SCHEMBL21016979 0.68 POLB (0.41) PDE4AAGO2ALDH1A1KDM4ELMNA
SCHEMBL16302668 0.68 PDE4A (0.57) PDE4AAGO2ALDH1A1KDM4ELMNA
SCHEMBL12010925 0.67 PDE4A (0.53) PDE4AAGO2ALDH1A1KDM4ELMNA
SCHEMBL17700671 0.63 NUDT1 (0.42) PDE4AAGO2ALDH1A1KDM4ELMNA
SCHEMBL20605048 0.61 HTT (0.41) ALDH1A1KDM4ELMNAUSP2POLB
SCHEMBL1312907 0.61 CA2 (0.36) ALDH1A1KDM4ELMNAUSP2MAPT

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-2014114694-A1 2,3-DIHYDROIMIDAZOL[1,2-C]PYRIMIDIN-5(1H)-ONE BASED LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 (LP-PLA2) INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2014-07-31 — — WO disclosed
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