SCHEMBL9637797

SCHEMBL9637797

CN(C)C(=O)c1cc(Cl)cc(C(=O)N(C)C)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
MALT1 Q9UDY8 1/20 0.44
NQO2 P16083 1/20 0.43
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.39
GPBAR1 Q8TDU6 2/20 0.38
ALPL P05186 1/20 0.37
CNR1 P21554 1/20 0.37
HPGD P15428 2/20 0.37
HTT P42858 1/20 0.37
KDM4A O75164 1/20 0.36
GFER P55789 1/20 0.36
GAA P10253 1/20 0.36
ATF1 P18846 1/20 0.36
NFKB1 P19838 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
BRD4 O60885 1/20 0.35
LMNA P02545 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
SCHEMBL3114046 0.83 ALDH1A1 (0.43) ALDH1A1MALT1NQO2MAPTL3MBTL1
SCHEMBL9636673 0.78 ALDH1A1 (0.44) ALDH1A1MALT1NQO2MAPTL3MBTL1
SCHEMBL31029421 0.76 ALDH1A1 (0.68) ALDH1A1MALT1MAPTL3MBTL1KDM4E
SCHEMBL19514135 0.76 MEN1 (0.48) ALDH1A1MALT1NQO2KDM4EGPBAR1
SCHEMBL26906287 0.76 NQO2 (0.43) ALDH1A1MALT1NQO2KDM4EGPBAR1
SCHEMBL621293 0.76 ALDH1A1 (0.68) ALDH1A1MALT1MAPTL3MBTL1KDM4E
SCHEMBL18839614 0.75 NQO2 (0.39) ALDH1A1MALT1NQO2KDM4EGPBAR1
SCHEMBL4574258 0.75 MAPT (0.44) ALDH1A1MAPTL3MBTL1KMT2ALMNA
SCHEMBL1004039 0.73 TPMT (0.52) ALDH1A1MAPTGPBAR1HPGDHTT
SCHEMBL3784787 0.73 TPMT (0.46) ALDH1A1MAPTGPBAR1HPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5094759-A Method of water treatment using 2,6-substituted aminopyridines and polymer derived therefrom THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1992-03-10 US disclosed
US-5026802-A Polymers derived from 2,6-substituted-4-amino-pyridines THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1991-06-25 US disclosed
US-4940796-A 2,6-substituted-4-aminopyridines and their corresponding intermediates THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1990-07-10 US disclosed