SCHEMBL7563746

SCHEMBL7563746

O=C(Cn1c(=O)n(S(=O)(=O)c2ccc(Cl)cc2)c(=O)c2ccc(Cl)cc21)Nc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
TP53 P04637 2/20 0.49
THRB P10828 1/20 0.48
PARG Q86W56 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
HDAC6 Q9UBN7 1/20 0.44
POLB P06746 1/20 0.43
KAT2B Q92831 1/20 0.43
S1PR2 O95136 1/20 0.43

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
SCHEMBL7472833 0.95 MAPT (0.48) MAPTTP53THRBALDH1A1LMNA
SCHEMBL7468006 0.91 MAPT (0.46) MAPTTP53ALDH1A1LMNAMEN1
SCHEMBL7460699 0.91 NLRP3 (0.45) MAPTTP53THRBKDM4EALDH1A1
SCHEMBL7468103 0.90 GAA (0.44) MAPTTP53THRBALDH1A1LMNA
SCHEMBL7468043 0.89 MAPT (0.48) MAPTTP53THRBKDM4ELMNA
SCHEMBL7461911 0.89 MAPT (0.44) MAPTTP53KDM4EALDH1A1HPGD
SCHEMBL7457276 0.88 MAPT (0.47) MAPTTP53THRBKDM4EALDH1A1
Iodide SCHEMBL7468583 0.88 MAPT (0.43) MAPTTP53THRBPARGALDH1A1
SCHEMBL7465177 0.87 S1PR2 (0.49) MAPTTP53KDM4EALDH1A1LMNA
Iodide SCHEMBL7462209 0.87 MAPT (0.41) MAPTTP53THRBPARGKDM4E

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-1224945-A1 TENSION-RELIEVING AGENTS FOR CILIARY MUSCLE Senju Pharmaceutical Co., Ltd. (JP) 2002-07-24 EP disclosed
EP-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 EP disclosed