SCHEMBL14404140

SCHEMBL14404140

CC/C(=N\NC(=O)c1ccccc1)c1cc(C)ccc1N

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.53
ALDH1A1 P00352 7/20 0.53
KDM4E B2RXH2 3/20 0.53
SMN1; SMN2 Q16637 7/20 0.53
RAB9A P51151 4/20 0.51
LMNA P02545 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
NPC1 O15118 4/20 0.46
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 1/20 0.44
GLA P06280 1/20 0.44
KCNMA1 Q12791 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
HDAC2 Q92769 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL14404177 0.89 MAPT (0.46) MAPTALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL14399940 0.86 KDM1A (0.57) MAPTALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL14404048 0.86 SMN1; SMN2 (0.54) MAPTALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL14404141 0.84 RAB9A (0.57) MAPTALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL14399899 0.80 MAPT (0.49) MAPTALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL14404038 0.79 MAPT (0.38) MAPTALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL27178196 0.77 MAPT (0.80) MAPTALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL27178203 0.77 MAPT (0.80) MAPTALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL30826067 0.77 MAPT (0.80) MAPTALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL14404098 0.76 MAPT (0.37) MAPTALDH1A1KDM4ESMN1; SMN2LMNA

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