SCHEMBL11346309

SCHEMBL11346309

C/C=C/CSC(=S)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
LMNA P02545 3/20 0.40
HTT P42858 2/20 0.40
MGLL Q99685 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
FAAH O00519 1/20 0.40
JAK2 O60674 1/20 0.40
BBOX1 O75936 1/20 0.40
TP53 P04637 1/20 0.40
ALDH2 P05091 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CYP3A4 P08684 1/20 0.40
FBP1 P09467 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
LOX P28300 1/20 0.40

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
SCHEMBL11039518 0.74
SCHEMBL9725666 0.72 PHGDH (0.31) ALDH1A1MGLLCYP3A4L3MBTL1
SCHEMBL8411971 0.70
SCHEMBL11222141 0.69 MGLL (0.55) ALDH1A1LMNAHTTMGLLKDM4E
SCHEMBL11612950 0.69 LMNA (0.34) ALDH1A1LMNAHTTMGLLKDM4E
SCHEMBL11612952 0.69 LMNA (0.34) ALDH1A1LMNAHTTMGLLKDM4E
SCHEMBL30446032 0.67 ALDH1A1 (0.50) ALDH1A1LMNAHTTMGLLKDM4E
SCHEMBL677364 0.67
SCHEMBL11306927 0.67 TRPA1 (0.31) ALDH1A1CYP3A4HPGDALOX15SMN1; SMN2
SCHEMBL4772651 0.64 LMNA (0.36) ALDH1A1LMNAHTTMGLLKDM4E

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
JP-55113707-A None JP disclosed
US-4281016-A DITHIOCARBAMATES HODOGAYA CHEMICALS CO., LTD. (JP) 1981-07-28 US disclosed
JP-S55113707-A NEMATOCIDE COMPOSITION HODOGAYA CHEM CO LTD 1980-09-02 JP disclosed