SCHEMBL1726488

SCHEMBL1726488

Cc1nn(C)c(N)c1-c1c(F)cc(Cl)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
PROKR1 Q8TCW9 6/20 0.36
FPR2 P25090 5/20 0.36
MAP3K14 Q99558 2/20 0.33
KMT2A Q03164 2/20 0.33
GRM4 Q14833 1/20 0.33
MAPK14 Q16539 1/20 0.33
PKM P14618 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
HSD11B1 P28845 1/20 0.32
POLB P06746 1/20 0.32
CDK8 P49336 1/20 0.32
ACVR1 Q04771 1/20 0.32
RIPK2 O43353 1/20 0.32
EGFR P00533 1/20 0.32
SRC P12931 1/20 0.32
BRAF P15056 1/20 0.32
KDR P35968 1/20 0.32
TNK2 Q07912 1/20 0.32

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
SCHEMBL1725188 0.92 MAPT (0.49) MAPTPROKR1FPR2MAP3K14KMT2A
SCHEMBL1724836 0.89 MAPT (0.44) MAPTPROKR1FPR2MAP3K14KMT2A
SCHEMBL1727252 0.84 MAPT (0.47) MAPTMAP3K14KMT2AMAPK14PKM
SCHEMBL29039033 0.80 MAPT (0.51) MAPTKMT2AMAPK14MEN1POLB
SCHEMBL29097494 0.79 MAPT (0.50) MAPTPROKR1MAP3K14KMT2AMAPK14
SCHEMBL16402315 0.79 MAPT (0.46) MAPTPROKR1FPR2KMT2AALDH1A1
SCHEMBL173553 0.75 PDE2A (0.47) MAPTPROKR1FPR2MAPK14PKM
SCHEMBL1726326 0.73 MAPT (0.59) MAPTKMT2AMAPK14PKMALDH1A1
SCHEMBL173619 0.73 HSD11B1 (0.47) MAPTKMT2AMAPK14HSD11B1
SCHEMBL29520229 0.73 HSD11B1 (0.47) MAPTKMT2AMAPK14HSD11B1

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-2403834-A1 Fungicidal pyrazoles E. I. du Pont de Nemours and Company (US) 2012-01-11 EP claimed