SCHEMBL7704672

SCHEMBL7704672

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

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.45
ALDH1A1 P00352 7/20 0.43
TDP1 Q9NUW8 2/20 0.43
GAA P10253 2/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 4/20 0.40
NR1H4 Q96RI1 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CNR1 P21554 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 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
SCHEMBL7700429 0.90 ALDH1A1 (0.45) MAPTALDH1A1TDP1TSHRHSD17B10
SCHEMBL7696341 0.89 MAPT (0.44) MAPTALDH1A1TDP1GAAHPGD
SCHEMBL7699868 0.88 ALDH1A1 (0.37) MAPTALDH1A1TDP1TSHRTP53
SCHEMBL7695041 0.88 TP53 (0.47) MAPTALDH1A1HPGDTSHRHSD17B10
SCHEMBL7696679 0.86 MAPT (0.42) MAPTALDH1A1TDP1GAAHPGD
SCHEMBL7696676 0.86 TP53 (0.43) MAPTALDH1A1TDP1TSHRHSD17B10
SCHEMBL7694366 0.85 MAPT (0.44) MAPTALDH1A1TDP1GAAHPGD
SCHEMBL7702473 0.84 ALDH1A1 (0.45) MAPTALDH1A1TDP1TSHRTP53
SCHEMBL7700902 0.83 ALDH1A1 (0.44) MAPTALDH1A1TDP1HPGDTSHR
SCHEMBL7702583 0.82 POLB (0.42) MAPTALDH1A1TDP1HPGDTSHR

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