SCHEMBL16227340

SCHEMBL16227340

CSC(=S)N(C)CN(C)C(=S)SC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.36
MGLL Q99685 4/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 3/20 0.36
TP53 P04637 2/20 0.36
ALDH2 P05091 2/20 0.36
HSP90AA1 P07900 2/20 0.36
CYP3A4 P08684 2/20 0.36
FBP1 P09467 2/20 0.36
MAPT P10636 2/20 0.36
PKM P14618 2/20 0.36
HPGD P15428 2/20 0.36
ALOX15 P16050 2/20 0.36
ALOX12 P18054 2/20 0.36
LOX P28300 2/20 0.36
LOXL3 P58215 2/20 0.36
KMT2A Q03164 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
LOXL4 Q96JB6 2/20 0.36
EHMT2 Q96KQ7 2/20 0.36

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
SCHEMBL14507923 0.80
SCHEMBL16327676 0.76
Cystogon SCHEMBL220119 0.71
SCHEMBL11541345 0.69 LMNA (0.40) HTTALDH1A1LMNAMAPTHPGD
SCHEMBL27464692 0.67
SCHEMBL20923539 0.67
SCHEMBL4601049 0.67
SCHEMBL16628497 0.67 MGLL (0.76) MGLLALDH1A1HPGDKMT2AMEN1
SCHEMBL20561014 0.65
Methyldiethyl Carbamodithioate SCHEMBL1608264 0.65

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
US-20140336090-A1 GREASE COMPOSITION AND BEARING KYODO YUSHI CO., LTD. (JP) 2014-11-13 US disclosed