SCHEMBL11222141

SCHEMBL11222141

CN(C)C(=S)SCSC(=S)N(C)C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 7/20 0.55
PHGDH O43175 3/20 0.55
ALDH1A1 P00352 8/20 0.53
LMNA P02545 5/20 0.53
HPGD P15428 4/20 0.53
HTT P42858 3/20 0.53
TP53 P04637 3/20 0.53
ALOX15 P16050 3/20 0.53
ALOX12 P18054 3/20 0.53
HSD17B10 Q99714 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
ALDH2 P05091 2/20 0.53
HSP90AA1 P07900 2/20 0.53
CYP3A4 P08684 2/20 0.53
FBP1 P09467 2/20 0.53
MAPT P10636 2/20 0.53
PKM P14618 2/20 0.53
LOX P28300 2/20 0.53
MAPK1 P28482 2/20 0.53
LOXL3 P58215 2/20 0.53

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
SCHEMBL677364 0.79
SCHEMBL30446032 0.79 ALDH1A1 (0.50) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL8411971 0.77
SCHEMBL11169326 0.75 ALDH1A1 (0.46) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL11043122 0.75
SCHEMBL14309246 0.73
SCHEMBL29857470 0.73 MGLL (0.43) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL8412640 0.73
SCHEMBL13450101 0.73 ALDH1A1 (0.43) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL23690531 0.71 LMNA (0.49) MGLLPHGDHALDH1A1LMNAHPGD

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
US-4383931-A Lubricating oils containing molybdenyl chelates GULF RESEARCH & DEVELOPMENT COMPANY (US) 1983-05-17 US claimed
US-20130284039-A1 RESIN COMPOSITION FOR LASER ENGRAVING, FLEXOGRAPHIC PRINTING PLATE PRECURSOR FOR LASER ENGRAVING AND PROCESS FOR PRODUCING SAME, AND FLEXOGRAPHIC PRINTING PLATE AND PROCESS FOR MAKING SAME FUJIFILM CORPORATION (JP) 2013-10-31 US disclosed
US-4383931-A Lubricating oils containing molybdenyl chelates GULF RESEARCH & DEVELOPMENT COMPANY (US) 1983-05-17 US disclosed