SCHEMBL10847653

SCHEMBL10847653

N#Cc1cnn(-c2c(F)c(F)cc(F)c2F)c1N

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.56
MEN1 O00255 2/20 0.56
KDM4E B2RXH2 1/20 0.56
XDH P47989 2/20 0.44
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HPGD P15428 2/20 0.36
PKM P14618 1/20 0.36
KHK P50053 1/20 0.36
ABL1 P00519 1/20 0.36
KDR P35968 1/20 0.36
CSNK2A1 P68400 1/20 0.35
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
MAPT P10636 2/20 0.34
HTT P42858 1/20 0.34
GLA P06280 1/20 0.33
RXFP1 Q9HBX9 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
SCHEMBL10616881 0.91 KMT2A (0.54) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL10845178 0.88 KMT2A (0.61) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL10985964 0.85 KMT2A (0.62) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL10616930 0.84 KMT2A (0.56) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL10618053 0.83 KMT2A (0.55) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL10620591 0.83 KMT2A (0.55) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL10857798 0.81 KMT2A (0.39) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL1881459 0.81 KMT2A (0.60) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL9453114 0.80 KMT2A (0.52) KMT2AMEN1KDM4EXDHALDH1A1
SCHEMBL10618033 0.79 KMT2A (0.55) KMT2AMEN1KDM4EXDHALDH1A1

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
US-4629495-A Herbicidal 5-amino-4-cyano-1-phenylpyrazoles MAY & BAKER LIMITED (GB) 1986-12-16 US disclosed