SCHEMBL14934909

SCHEMBL14934909

CC1(C)OB(c2ccc(COC(=O)NCc3ccccc3)cc2)OC1(C)C

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.55
NFE2L2 Q16236 1/20 0.55
PLAU P00749 1/20 0.53
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
NAMPT P43490 1/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC2 Q92769 2/20 0.48
HDAC3 O15379 1/20 0.48
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TNKS O95271 1/20 0.46
TNKS2 Q9H2K2 1/20 0.46
DGAT1 O75907 1/20 0.46
ELANE P08246 2/20 0.45
LIPG Q9Y5X9 2/20 0.45
LPL P06858 1/20 0.44

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
SCHEMBL16030765 1.00 KEAP1 (0.55) KEAP1NFE2L2PLAUCA1CA2
SCHEMBL14934888 0.88 KEAP1 (0.46) KEAP1NFE2L2PLAUCA1CA2
SCHEMBL29707329 0.88 CA2 (0.52) KEAP1NFE2L2CA1CA2CA9
SCHEMBL29707332 0.88 CA2 (0.52) KEAP1NFE2L2CA1CA2CA9
SCHEMBL9986027 0.87 CA1 (0.53) KEAP1NFE2L2CA1CA2CA9
SCHEMBL16247338 0.87 KEAP1 (0.46) KEAP1NFE2L2PLAUCA1CA2
SCHEMBL30543686 0.85 HTT (0.51) KEAP1NFE2L2CA1CA2CA9
SCHEMBL24142282 0.85 LIPG (0.54) KEAP1NFE2L2CA1CA2CA9
SCHEMBL25217470 0.84 L3MBTL1 (0.42) KEAP1NFE2L2PLAULMNASMN1; SMN2
SCHEMBL4823829 0.84 POLB (0.54) CA1CA2CA9NAMPTSMN1; SMN2

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-2013067349-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2013-05-10 WO disclosed