SCHEMBL14159939

SCHEMBL14159939

CCCCCCOCCNc1nc(F)nc(Nc2ccc(N=Nc3cc(C)c4cccc(C)c4c3)c(NC(C)=O)c2)n1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KCNH3 Q9ULD8 3/20 0.33
▸ JAK2 O60674 2/20 0.31
▸ HDAC1 Q13547 2/20 0.31
▸ HDAC6 Q9UBN7 2/20 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
SCHEMBL14159940 0.83 MAPT (0.39) —
SCHEMBL14159933 0.82 MAPT (0.37) JAK2HDAC1
SCHEMBL13823097 0.76 ATIC (0.36) KCNH3
SCHEMBL13881108 0.75 ATIC (0.42) KCNH3
SCHEMBL14159927 0.75 POLB (0.46) —
SCHEMBL14159928 0.74 NFKB1 (0.46) JAK2HDAC1
SCHEMBL14159205 0.72 SLC2A1 (0.46) KCNH3
SCHEMBL14094971 0.71 MAPT (0.47) —
SCHEMBL13611634 0.69 KCNH3 (0.32) KCNH3
SCHEMBL14134398 0.69 KCNH3 (0.37) KCNH3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7381256-B2 Mixtures of fiber-reactive azo dyes, their production and their use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-06-03 — — US disclosed
US-20070209540-A1 Mixtures Of Fiber-Reactive Azo Dyes, Their Production And Their Use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2007-09-13 — — US disclosed
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