SCHEMBL8288656

SCHEMBL8288656

NC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)sc2c1CCCC2

nearest known ligand 0.84

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.84
ALDH1A1 P00352 3/20 0.84
SMN1; SMN2 Q16637 2/20 0.84
KMT2A Q03164 6/20 0.77
MEN1 O00255 3/20 0.71
CRHBP P24387 1/20 0.71
CRHR2 Q13324 1/20 0.71
ALOX15 P16050 2/20 0.68
HSD17B10 Q99714 2/20 0.68
USP2 O75604 1/20 0.68
FLT3 P36888 7/20 0.67
NPC1 O15118 2/20 0.65
RAB9A P51151 2/20 0.65
TSHR P16473 1/20 0.65
KDM4E B2RXH2 1/20 0.64
CLK1 P49759 1/20 0.63
GFER P55789 1/20 0.63
TP53 P04637 1/20 0.63

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
SCHEMBL8288765 0.92 MAPT (0.98) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL23711014 0.88 MAPT (0.81) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL21651804 0.87 MAPT (0.98) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL8290348 0.82 MAPT (0.75) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL14666759 0.81 MAPT (1.00) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL8290663 0.81 FLT3 (1.00) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL8289853 0.80 FLT3 (0.97) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL8289526 0.80 RAB9A (0.95) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL5463079 0.80 FLT3 (1.00) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL3128198 0.80 FLT3 (1.00) MAPTALDH1A1SMN1; SMN2KMT2AMEN1

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
WO-2005033102-A2 THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF AMPHORA DISCOVERY CORPORATION (US) 2005-04-14 WO disclosed