SCHEMBL5209210

SCHEMBL5209210

CSCC(c1ccc(C(CSC)C2SCC(CO)S2)cc1)C1SCC(CO)S1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
ESR1 P03372 1/20 0.31
ESR2 Q92731 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
SCHEMBL5211512 0.89 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3
SCHEMBL5210012 0.85
SCHEMBL5207137 0.80
SCHEMBL5210722 0.75
SCHEMBL5212349 0.72
SCHEMBL5210106 0.72
SCHEMBL5209682 0.72 SLC6A4 (0.31) SLC6A4
SCHEMBL5209981 0.70
SCHEMBL6601620 0.69 SMN1; SMN2 (0.35)
SCHEMBL5209654 0.68

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
EP-1388540-B1 ACRYLIC ESTERS AND USE THEREOF MITSUI CHEMICALS INC (JP) 2007-09-05 EP disclosed