SCHEMBL14404175

SCHEMBL14404175

C/C(=N\NC(=O)c1ccccc1Cl)c1cc(C)ccc1N

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
MAPT P10636 5/20 0.54
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
AGTR1 P30556 1/20 0.54
OPRK1 P41145 1/20 0.54
KDM4E B2RXH2 5/20 0.53
CYP3A4 P08684 2/20 0.52
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
GAA P10253 2/20 0.48
NPC1 O15118 2/20 0.46
LMNA P02545 1/20 0.46
RECQL P46063 2/20 0.45
ABCB1 P08183 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
L3MBTL1 Q9Y468 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
SCHEMBL14399900 0.89 RECQL (0.59) ALDH1A1MAPTKMT2AMEN1AGTR1
SCHEMBL14404178 0.86 MAPT (0.53) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL683929 0.86 KDM4E (0.60) ALDH1A1MAPTKMT2AMEN1AGTR1
SCHEMBL14404141 0.83 RAB9A (0.57) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL14404174 0.81 MAPT (0.54) ALDH1A1MAPTKMT2AMEN1AGTR1
SCHEMBL14404040 0.80 MAPT (0.45) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL14400032 0.78 MAPT (0.57) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL9654244 0.78 RECQL (0.71) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL684651 0.77 KDM1A (0.65) ALDH1A1MAPTKMT2AMEN1AGTR1
SCHEMBL14404109 0.76 GAA (0.40) ALDH1A1MAPTKMT2AMEN1KDM4E

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