SCHEMBL6686449

SCHEMBL6686449

CCOC(=O)CC1=NS(=O)(=O)c2c(OC)ccc(Cl)c2N1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
ALDH1A1 P00352 7/20 0.34
RAB9A P51151 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CASP1 P29466 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
DPP4 P27487 2/20 0.33
POLB P06746 1/20 0.32
DRD2 P14416 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL6687177 0.86 GAA (0.35) MAPTALDH1A1HPGDHSD17B10GAA
SCHEMBL6686427 0.80 LMNA (0.40) MAPTALDH1A1RAB9AHPGDHSD17B10
SCHEMBL6686746 0.76 MAPT (0.41) MAPTALDH1A1RAB9AGAATSHR
SCHEMBL6689528 0.68 MEN1 (0.39) MAPTALDH1A1RAB9AHPGDHSD17B10
SCHEMBL27649383 0.68 CHEK1 (0.37) ALDH1A1RAB9AHPGDHSD17B10MEN1
SCHEMBL5097715 0.68 KMT2A (0.42) MAPTALDH1A1RAB9ATSHRMEN1
SCHEMBL5097658 0.68 ALDH1A1 (0.54) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL6233072 0.66 RECQL (0.40) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL335430 0.66 MEN1 (0.34) ALDH1A1GAATSHRMEN1KMT2A
SCHEMBL27649419 0.65 LMNA (0.33) MAPTALDH1A1RAB9AGAAMEN1

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-2004052312-A2 ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION (US) 2004-06-24 WO claimed
WO-2004052312-A2 ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION (US) 2004-06-24 WO disclosed