SCHEMBL9768124

SCHEMBL9768124

CSC(=NOC(C)=O)C(C)=NN(Cl)c1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.33
KDM4E B2RXH2 3/20 0.33
PDK2 Q15119 2/20 0.33
ALDH1A1 P00352 6/20 0.32
HPGD P15428 2/20 0.32
CYP2C19 P33261 2/20 0.32
USP2 O75604 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PDE2A O00408 2/20 0.32
MRGPRX4 Q96LA9 4/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ACACB O00763 1/20 0.31
RAB9A P51151 1/20 0.31
GAA P10253 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 1/20 0.30

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
SCHEMBL9218168 0.78 MAPT (0.43) MAPTKDM4EALDH1A1HPGDCYP2C19
SCHEMBL10437726 0.76 MAPT (0.37) MAPTKDM4EPDK2ALDH1A1CYP2C19
SCHEMBL9768128 0.73 GABRP (0.33) MAPTKDM4EALDH1A1HPGDMEN1
SCHEMBL9704229 0.70 MAPT (0.47) MAPTKDM4EALDH1A1HPGDCYP2C19
SCHEMBL9218664 0.70 MAPT (0.47) MAPTKDM4EALDH1A1HPGDMRGPRX4
SCHEMBL6258555 0.69 PDE2A (0.39) MAPTPDK2ALDH1A1PDE2AMRGPRX4
SCHEMBL9217501 0.69 MAPT (0.45) MAPTKDM4EALDH1A1HPGDCYP2C19
SCHEMBL9704795 0.68 MAPT (0.47) MAPTKDM4EALDH1A1HPGDMRGPRX4
SCHEMBL9212175 0.68 MAPT (0.46) MAPTKDM4EALDH1A1HPGDMRGPRX4
SCHEMBL9216173 0.67 MAPT (0.42) MAPTKDM4EALDH1A1HPGDCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5064844-A Miticides SCHERING AGROCHEMICALS LIMITED (GB) 1991-11-12 US disclosed
EP-0350237-A2 Triazole insecticides SCHERING AGROCHEMICALS LIMITED (GB) 1990-01-10 EP disclosed