SCHEMBL7467040

SCHEMBL7467040

O=C(Cn1c(=O)n(S(=O)(=O)c2ccc(Cl)cc2)c(=O)c2ccc(Cl)cc21)NN1CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.43
MAPT P10636 2/20 0.41
MAPK8 P45983 2/20 0.40
MAPK9 P45984 1/20 0.40
MAPK10 P53779 1/20 0.40
HTR6 P50406 6/20 0.37
TP53 P04637 1/20 0.37
USP2 O75604 1/20 0.37
HDAC6 Q9UBN7 2/20 0.37
HTR1A P08908 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
HDAC1 Q13547 1/20 0.35
HDAC8 Q9BY41 1/20 0.35

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
SCHEMBL7469653 0.85 HDAC6 (0.43) MAPTMAPK8MAPK9HTR6TP53
SCHEMBL7472833 0.83 MAPT (0.48) CMA1MAPTTP53USP2SMN1; SMN2
SCHEMBL7465874 0.81 AKR1B1 (0.50) CMA1HDAC6PSEN1PSEN2APH1B
SCHEMBL7463225 0.81 CMA1 (0.42) CMA1MAPTTP53HDAC6SMN1; SMN2
SCHEMBL7563746 0.80 MAPT (0.49) MAPTTP53HDAC6POLB
SCHEMBL7459066 0.80 KMT2A (0.54) MAPTTP53SMN1; SMN2
SCHEMBL7468006 0.80 MAPT (0.46) CMA1MAPTTP53SMN1; SMN2POLB
SCHEMBL7468103 0.79 GAA (0.44) CMA1MAPTTP53SMN1; SMN2
SCHEMBL7465395 0.79 TP53 (0.51) CMA1MAPTTP53HDAC6SMN1; SMN2
SCHEMBL7465177 0.78 S1PR2 (0.49) CMA1MAPTTP53HDAC6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795548-B1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LTD (JP) 2002-07-03 EP disclosed
EP-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 EP disclosed