SCHEMBL10817138

SCHEMBL10817138

Cc1cc(SSc2cc(C)c(Cl)cc2Cl)c(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.44
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
CYP3A4 P08684 2/20 0.36
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.32
FBP1 P09467 1/20 0.32
AR P10275 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL10818701 0.84 CD44 (0.44) CD44KMT2AGAAGRIN2DGRIN3B
SCHEMBL13696487 0.82 CD44 (0.42) CD44KMT2AGAAGRIN2DGRIN3B
SCHEMBL30050744 0.77 MEN1 (0.48) KMT2ACYP3A4MEN1FBP1
SCHEMBL4636283 0.77 MEN1 (0.48) KMT2ACYP3A4MEN1FBP1
SCHEMBL8261003 0.76 CD44 (0.58) CD44GAAGRIN2DGRIN3BGRIN1
SCHEMBL168826 0.74 CD44 (0.55) CD44GAAGRIN2DGRIN3BGRIN1
SCHEMBL120848 0.73 CD44 (0.61) CD44GAAGRIN2DGRIN3BGRIN1
SCHEMBL27064470 0.72 CD44 (0.42) CD44KMT2AGAAGRIN2DGRIN3B
SCHEMBL17325396 0.71 GAA (0.42) CD44KMT2AGAA
Water SCHEMBL29026586 0.70 CD44 (0.58) CD44GAAGRIN2DGRIN3BGRIN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0093363-B1 PROCESS FOR THE PREPARATION OF DISULPHIDES CASSELLA Aktiengesellschaft (DE) 1987-01-14 EP disclosed
EP-0093363-A1 Process for the preparation of disulphides CASSELLA Aktiengesellschaft (DE) 1983-11-09 EP disclosed