SCHEMBL9705658

SCHEMBL9705658

S=C(S)Nc1ccccc1N(C(=S)S)C(=S)S

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.32
ABCC1 P33527 1/20 0.32
ALDH1A1 P00352 4/20 0.31
LMNA P02545 3/20 0.31
KMT2A Q03164 2/20 0.31
MASP2 O00187 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 2/20 0.30
CYP3A4 P08684 1/20 0.30
TAS2R38 P59533 1/20 0.30
MEN1 O00255 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL6032044 0.79 ALDH1A1 (0.42) L3MBTL1ALDH1A1LMNAKMT2AKDM4E
SCHEMBL11500810 0.71 NPC1 (0.48) ALDH1A1LMNAKMT2AKDM4EMAPT
SCHEMBL11310301 0.69 NPC1 (0.57) L3MBTL1ALDH1A1LMNAKMT2AKDM4E
SCHEMBL11436972 0.69 ALDH1A1 (0.60) ALDH1A1LMNAKMT2AKDM4EMAPT
SCHEMBL8468623 0.69 HDAC3 (0.50) L3MBTL1ALDH1A1LMNAKMT2AKDM4E
Ammonia Solution, Strong SCHEMBL11800520 0.68 HDAC3 (0.48) L3MBTL1ALDH1A1LMNAKMT2AKDM4E
SCHEMBL19656392 0.67 ALDH1A1 (0.41) ABCC1ALDH1A1KMT2AMASP2KDM4E
SCHEMBL1080942 0.65 MAPT (0.64) L3MBTL1ALDH1A1LMNAKMT2AMAPT
SCHEMBL27609154 0.65 SMN1; SMN2 (0.56) L3MBTL1ALDH1A1LMNAKMT2AKDM4E
SCHEMBL10969521 0.64 TTR (0.41) L3MBTL1ALDH1A1KDM4EMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0211305-B1 METAL SCAVENGING PROCESS MIYOSHI YUSHI KABUSHIKI KAISHA (JP) 1992-07-01 EP disclosed
US-4731187-A Removal of heavy metals from waste water MIYOSHI YUSHI KABUSHIKI KAISHA 1988-03-15 US disclosed
EP-0211305-A2 Metal scavenging process MIYOSHI YUSHI KABUSHIKI KAISHA (JP) 1987-02-25 EP disclosed