SCHEMBL7694366

SCHEMBL7694366

COc1ccc(CC(N)c2oc(-c3ccccc3C)nc2S(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
ALDH1A1 P00352 5/20 0.43
GAA P10253 2/20 0.43
HPGD P15428 2/20 0.43
TDP1 Q9NUW8 2/20 0.41
TP53 P04637 2/20 0.40
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
TSHR P16473 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
UBE2N P61088 1/20 0.37

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
SCHEMBL7696848 0.93 ALDH1A1 (0.49) MAPTALDH1A1GAAHPGDTDP1
SCHEMBL7700070 0.90 TP53 (0.49) MAPTALDH1A1GAAHPGDTP53
SCHEMBL7698777 0.89 MAPT (0.40) MAPTALDH1A1GAAHPGDTDP1
SCHEMBL7697504 0.89 MAPT (0.38) MAPTALDH1A1GAAHPGDTP53
SCHEMBL7694774 0.87 MAPT (0.41) MAPTALDH1A1GAAHPGDTDP1
SCHEMBL7704672 0.85 MAPT (0.45) MAPTALDH1A1GAAHPGDTDP1
SCHEMBL7699872 0.85 ALDH1A1 (0.42) MAPTALDH1A1TDP1TP53MAPK1
SCHEMBL7700867 0.83 ALDH1A1 (0.41) MAPTALDH1A1TDP1TP53MAPK1
SCHEMBL7696341 0.79 MAPT (0.44) MAPTALDH1A1GAAHPGDTDP1
SCHEMBL7704674 0.78 MAPT (0.69) MAPTALDH1A1GAAHPGDTDP1

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