SCHEMBL10429016

SCHEMBL10429016

FC(F)=C(F)CCSc1nnc(Sc2ccc(Cl)cc2)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.41
ALDH1A1 P00352 6/20 0.37
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
NPSR1 Q6W5P4 3/20 0.37
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 5/20 0.36
MAPT P10636 3/20 0.36
TP53 P04637 2/20 0.36
HSD11B1 P28845 1/20 0.36
FBP1 P09467 1/20 0.36
KDM4E B2RXH2 1/20 0.35
POLB P06746 2/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.33
ABL1 P00519 1/20 0.33
SRC P12931 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
SCHEMBL10364751 0.81 KMT2A (0.52) APEX1ALDH1A1KMT2AMEN1NPSR1
SCHEMBL10363086 0.80 APEX1 (0.59) APEX1ALDH1A1KMT2ANPSR1HTT
SCHEMBL20506744 0.79 APEX1 (0.46) APEX1ALDH1A1KMT2AMEN1NPSR1
SCHEMBL10428940 0.74 APEX1 (0.52) APEX1ALDH1A1KMT2ANPSR1HTT
SCHEMBL10362960 0.72 APEX1 (0.50) APEX1ALDH1A1KMT2AMEN1NPSR1
SCHEMBL10363208 0.72 APEX1 (0.50) APEX1ALDH1A1KMT2AMEN1NPSR1
SCHEMBL10363686 0.71 LMNA (0.57) APEX1ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL10363048 0.69 TERT (0.51) APEX1ALDH1A1KMT2AMEN1HTT
SCHEMBL20506750 0.69 ALDH1A1 (0.52) APEX1ALDH1A1KMT2AMEN1NPSR1
SCHEMBL20506738 0.69 GAA (0.50) APEX1ALDH1A1KMT2AMEN1NPSR1

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-4952580-A NEMATOCIDES, ANTHELMINTICS FMC CORPORATION (US) 1990-08-28 US claimed