SCHEMBL7698768

SCHEMBL7698768

NC(c1ccc(F)cc1)c1oc(-c2ccccc2C(F)(F)F)nc1S(=O)(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
PLA2G1B P04054 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43
TP53 P04637 5/20 0.43
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 3/20 0.42
KMT2A Q03164 3/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
THRB P10828 1/20 0.41
C1R P00736 1/20 0.41
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
GAA P10253 1/20 0.38

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
SCHEMBL7696679 0.88 MAPT (0.42) ALDH1A1TP53MAPTTSHRKMT2A
SCHEMBL7695041 0.85 TP53 (0.47) ALDH1A1PLA2G1BNPSR1ATG4BTP53
SCHEMBL7698858 0.84 MAPT (0.57) ALDH1A1NPSR1TP53MAPTSMN1; SMN2
SCHEMBL7696766 0.80 ALDH1A1 (0.40) ALDH1A1TP53MAPTSMN1; SMN2TSHR
SCHEMBL7701098 0.77 ALDH1A1 (0.37) ALDH1A1NPSR1TP53MAPTSMN1; SMN2
SCHEMBL7696676 0.76 TP53 (0.43) ALDH1A1NPSR1TP53MAPTSMN1; SMN2
SCHEMBL7701107 0.75 C1R (0.46) ALDH1A1NPSR1TP53MAPTSMN1; SMN2
SCHEMBL7698770 0.75 MAPT (0.61) ALDH1A1TP53MAPTTSHRKMT2A
SCHEMBL7694774 0.74 MAPT (0.41) ALDH1A1TP53MAPTKMT2AHPGD
SCHEMBL7696896 0.74 KMT2A (0.41) ALDH1A1PLA2G1BNPSR1ATG4BTP53

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