SCHEMBL14558162

SCHEMBL14558162

CSc1cc(N)c(S)cc1O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.35
ALOX15 P16050 4/20 0.35
HSD17B10 Q99714 3/20 0.35
GAA P10253 4/20 0.32
MEN1 O00255 3/20 0.32
MAPT P10636 3/20 0.32
KMT2A Q03164 3/20 0.32
ALOX12 P18054 3/20 0.32
RECQL P46063 2/20 0.32
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
HIF1A Q16665 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 1/20 0.31
THRB P10828 1/20 0.31
BLM P54132 1/20 0.31
MCL1 Q07820 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HPGD P15428 2/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL13754607 0.79 NPC1 (0.33)
SCHEMBL8781023 0.77 ALDH1A1 (0.38) ALDH1A1ALOX15HSD17B10GAAMEN1
SCHEMBL18201986 0.76 ALOX15 (0.36) ALDH1A1ALOX15HSD17B10GAAMEN1
Hydrochloric Acid SCHEMBL9131059 0.76 ALDH1A1 (0.37) ALDH1A1ALOX15HSD17B10GAAMEN1
SCHEMBL14283780 0.75 ALOX15 (0.40) ALDH1A1ALOX15HSD17B10GAAMEN1
SCHEMBL19975207 0.74 ALDH1A1 (0.41) ALDH1A1ALOX15HSD17B10GAAMEN1
Hydrochloric Acid SCHEMBL21173934 0.72 ALDH1A1 (0.39) ALDH1A1ALOX15HSD17B10GAAMEN1
SCHEMBL19975253 0.69 ALDH1A1 (0.41) ALDH1A1ALOX15HSD17B10GAAMEN1
SCHEMBL9737956 0.68 TSHR (0.43) ALDH1A1ALOX15HSD17B10GAAMAPT
Hydrochloric Acid SCHEMBL21173925 0.67 ALDH1A1 (0.39) ALDH1A1ALOX15HSD17B10GAAMEN1

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
US-7192947-B2 Peptides derivatives comprising thiazepine group for the treatment of hyperlipidemic conditions ASTRAZENECA AB (SE) 2007-03-20 US disclosed
US-7192947-B2 Peptides derivatives comprising thiazepine group for the treatment of hyperlipidemic conditions ASTRAZENECA AB (SE) 2007-03-20 US disclosed