SCHEMBL28057338

SCHEMBL28057338

Cc1nn(C)c(Nc2c(F)cc(F)c(Cl)c2Cl)c1-c1c(F)cccc1F

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.33
GRM4 Q14833 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
TP53 P04637 1/20 0.32
SLC34A1 Q06495 6/20 0.31
BRD4 O60885 2/20 0.31
PDE2A O00408 1/20 0.31
PDE10A Q9Y233 1/20 0.31
NMT1 P30419 1/20 0.30
LMNA P02545 2/20 0.30
KDM4E B2RXH2 1/20 0.30
GALR3 O60755 1/20 0.30
HTT P42858 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
SCHEMBL173314 0.88 GRM4 (0.39) MAPTGRM4SMN1; SMN2PDE2APDE10A
SCHEMBL168112 0.84 MAPT (0.34) MAPTGRM4SLC34A1PDE2APDE10A
SCHEMBL173330 0.84 FTO (0.36) MAPTGRM4SLC34A1PDE2APDE10A
SCHEMBL173648 0.82 NMT1 (0.41) MAPTSMN1; SMN2TP53NMT1LMNA
SCHEMBL28826756 0.82 SLC34A1 (0.44) MAPTSLC34A1
SCHEMBL30582142 0.79 MAPT (0.35) MAPTSMN1; SMN2TP53SLC34A1PDE2A
SCHEMBL170377 0.79 KMT2A (0.39) MAPTSMN1; SMN2NMT1KDM4EGALR3
SCHEMBL170975 0.78 MAPT (0.38) MAPTSMN1; SMN2TP53NMT1KDM4E
SCHEMBL9998001 0.77 MEN1 (0.36) MAPTGRM4SMN1; SMN2PDE2APDE10A
SCHEMBL14957074 0.76 MAPT (0.40) MAPTSMN1; SMN2KDM4EGALR3HTT

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
CN-103140136-B fungicidal pyrazoles and mixtures thereof DUPONT (US) 2016-05-11 CN disclosed