SCHEMBL7952884

SCHEMBL7952884

CCSN(SCC)C(=S)CC

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 2/20 0.31
MGLL Q99685 2/20 0.31
PLIN1 O60240 1/20 0.31
GMNN O75496 1/20 0.31
TRPA1 O75762 1/20 0.31
ABCB11 O95342 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
ALDH2 P05091 1/20 0.31
CYP1A2 P05177 1/20 0.31
HSP90AA1 P07900 1/20 0.31
CYP3A4 P08684 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
FBP1 P09467 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
MAPT P10636 1/20 0.31
CHRM1 P11229 1/20 0.31
CYP2C9 P11712 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
SCHEMBL1079287 0.83 PHGDH (0.31) PHGDHMGLLPLIN1GMNNTRPA1
SCHEMBL1096599 0.81
SCHEMBL8086642 0.79
SCHEMBL8086452 0.75 ALDH1A1 (0.35) MGLLALDH1A1TP53ALDH2
SCHEMBL7947526 0.74
SCHEMBL11399453 0.72 PHGDH (0.31) PHGDHMGLLPLIN1GMNNTRPA1
SCHEMBL11229111 0.72 PHGDH (0.31) PHGDHMGLLPLIN1GMNNTRPA1
SCHEMBL8816142 0.72 ALDH1A1 (0.48) PHGDHMGLLPLIN1GMNNTRPA1
SCHEMBL5747742 0.72
SCHEMBL1079074 0.72

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-6265499-B1 POLYMERIZING MIXTURE MENICON CO., LTD. (JP) 2001-07-24 US claimed