SCHEMBL13615001

SCHEMBL13615001

CCOC(=O)NC1=NS(=O)(=O)c2cccc(OCCOC)c21

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
MAPT P10636 4/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 2/20 0.38
NPSR1 Q6W5P4 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.36
HPGD P15428 3/20 0.36
RAB9A P51151 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
MTNR1B P49286 1/20 0.36
TP53 P04637 1/20 0.36
NPC1 O15118 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
NLRP3 Q96P20 1/20 0.35
KIT P10721 1/20 0.35

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
SCHEMBL13615127 0.74 ALDH1A1 (0.53) TSHRMAPTPOLBALDH1A1KDM4E
SCHEMBL13614998 0.74 HSD17B10 (0.36) MAPTPOLBALDH1A1KDM4EHSD17B10
SCHEMBL4391092 0.72 KCNA3 (0.39) ALDH1A1HPGDLMNA
SCHEMBL2570228 0.71 DYRK1A (0.42) ALDH1A1KDM4EHSD17B10SMN1; SMN2HPGD
SCHEMBL13615350 0.69 TYK2 (0.41) TSHRPOLBALDH1A1KDM4EHSD17B10
SCHEMBL10525830 0.65 GAA (0.38) TSHRMAPTPOLBNPSR1SMN1; SMN2
SCHEMBL12292136 0.64 HSD17B10 (0.44) POLBALDH1A1HSD17B10LMNAGAA
SCHEMBL23352278 0.63 NPSR1 (0.43) TSHRALDH1A1KDM4ENPSR1SMN1; SMN2
SCHEMBL28701055 0.63 TSHR (0.61) TSHRMAPTPOLBALDH1A1KDM4E
SCHEMBL12292129 0.62 HSD17B10 (0.43) MAPTPOLBALDH1A1HSD17B10SMN1; SMN2

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-2009141065-A2 (1,2-BENZISOTHIAZOL-3-YL)(THIO)CARBAMATES AND (1,2-BENZISOTHIAZOL-3-YL)(THIO)OXAMATES AND THE OXIDATION FORMS THEREOF FOR USE AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2009-11-26 WO disclosed