SCHEMBL14404177

SCHEMBL14404177

CC/C(=N\NC(=O)c1ccc(Cl)cc1)c1cc(C)ccc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
RAB9A P51151 5/20 0.44
ALDH1A1 P00352 4/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 5/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KCNK3 O14649 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
LMNA P02545 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
SCN5A Q14524 1/20 0.42
SCN2A Q99250 1/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA4 P22748 2/20 0.42
CA9 Q16790 2/20 0.42

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
SCHEMBL14399899 0.91 MAPT (0.49) MAPTRAB9AALDH1A1POLBKDM4E
SCHEMBL14404140 0.89 MAPT (0.53) MAPTRAB9AALDH1A1KDM4ENPC1
SCHEMBL14399940 0.85 KDM1A (0.57) MAPTRAB9AALDH1A1POLBKDM4E
SCHEMBL14404174 0.84 MAPT (0.54) MAPTRAB9AALDH1A1POLBNPC1
SCHEMBL14404048 0.81 SMN1; SMN2 (0.54) MAPTRAB9AALDH1A1POLBKDM4E
SCHEMBL14399703 0.78 TDP1 (0.56) MAPTRAB9AALDH1A1POLBKDM4E
SCHEMBL14399826 0.77 RECQL (0.57) MAPTRAB9AALDH1A1KDM4ENPC1
SCHEMBL19010187 0.76 MAPT (0.71) MAPTRAB9AALDH1A1POLBNPC1
SCHEMBL14404038 0.76 MAPT (0.38) MAPTALDH1A1KDM4ENPC1MAPK1
SCHEMBL14399905 0.76 TDP1 (0.45) MAPTRAB9AALDH1A1POLBKDM4E

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-2007116314-A1 N-PHENYL-1,1,1-TRIFLUOROMETHANESULFONAMIDE HYDRAZONE DERIVATIVE COMPOUNDS AND THEIR USAGE IN CONTROLLING PARASITES SCHERING-PLOUGH LTD. (US) 2007-10-18 WO disclosed