SCHEMBL7703760

SCHEMBL7703760

COCCN(c1oc(-c2cc(F)ccc2C)nc1S(=O)(=O)c1ccccc1)C(N)COC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 5/20 0.39
TP53 P04637 4/20 0.39
THRB P10828 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MEN1 O00255 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HPGD P15428 1/20 0.36
LMNA P02545 2/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7700431 0.74 TP53 (0.47) TSHRALDH1A1MAPTTP53THRB
SCHEMBL7696409 0.74 KMT2A (0.43) TSHRALDH1A1MAPTTP53THRB
SCHEMBL7701850 0.73 TP53 (0.40) TSHRALDH1A1MAPTTP53THRB
SCHEMBL7696411 0.72 MEN1 (0.44) TSHRALDH1A1MAPTTP53THRB
SCHEMBL7698777 0.72 MAPT (0.40) TSHRALDH1A1MAPTTP53THRB
SCHEMBL7700433 0.71 KMT2A (0.69) TSHRALDH1A1MAPTTP53THRB
SCHEMBL7699872 0.70 ALDH1A1 (0.42) TSHRALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL7701852 0.69 MAPT (0.51) ALDH1A1MAPTTP53KMT2AMEN1
SCHEMBL7700867 0.68 ALDH1A1 (0.41) TSHRALDH1A1MAPTTP53SMN1; SMN2
SCHEMBL7700535 0.67 KMT2A (0.52) TSHRALDH1A1MAPTTP53THRB

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-2002100842-A1 SULFONYLOXAZOLAMINES AND THEIR USE AS 5-HT6 LIGANDS MERCK PATENT GMBH (DE) 2002-12-19 WO disclosed