SCHEMBL10437726

SCHEMBL10437726

CC(=NN(Cl)c1ccc(C(F)(F)F)cc1Cl)C(=O)NO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
PDK2 Q15119 2/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
PDE2A O00408 2/20 0.37
ACACB O00763 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
CYP2D6 P10635 1/20 0.33
HTT P42858 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33

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
SCHEMBL9768124 0.76 MAPT (0.33) MAPTKDM4EPDK2PDE2AACACB
SCHEMBL6258555 0.75 PDE2A (0.39) MAPTPDK2PDE2AACACBGAA
SCHEMBL9218664 0.73 MAPT (0.47) MAPTKDM4EGAAALDH1A1
SCHEMBL9217501 0.73 MAPT (0.45) MAPTKDM4EGAAALDH1A1CYP1A2
SCHEMBL9704795 0.71 MAPT (0.47) MAPTKDM4EGAAALDH1A1
SCHEMBL9704229 0.71 MAPT (0.47) MAPTKDM4EGAAALDH1A1CYP1A2
SCHEMBL9218168 0.71 MAPT (0.43) MAPTKDM4EGAAALDH1A1CYP1A2
SCHEMBL9215595 0.70 MAPT (0.46) MAPTKDM4EGAAALDH1A1
SCHEMBL8346846 0.68 PDK2 (0.51) MAPTKDM4EPDK2PDE2ALMNA
SCHEMBL9704767 0.68 PDE2A (0.37) MAPTKDM4EPDK2PDE2AGAA

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
EP-0350237-A2 Triazole insecticides SCHERING AGROCHEMICALS LIMITED (GB) 1990-01-10 EP disclosed