SCHEMBL625438

SCHEMBL625438

CN1CCc2sc(NC(=O)C(OC3CCCCC3)c3ccc(S(=O)(=O)C4CCCC4)cn3)nc2C1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCK P35557 18/20 0.47
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
USP2 O75604 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL623747 0.99 GCK (0.48) GCKALDH1A1LMNAUSP2MAPK1
SCHEMBL624715 0.88 GCK (0.57) GCK
SCHEMBL627287 0.88 GCK (0.51) GCKALDH1A1LMNAUSP2MAPK1
SCHEMBL626912 0.87 GCK (0.52) GCKALDH1A1LMNAUSP2MAPK1
SCHEMBL625184 0.77 GCK (0.49) GCK
SCHEMBL625466 0.76 GCK (0.49) GCK
SCHEMBL626483 0.75 GCK (0.65) GCKALDH1A1LMNAUSP2MAPK1
SCHEMBL625064 0.74 GCK (0.57) GCK
SCHEMBL623375 0.73 GCK (0.57) GCK
SCHEMBL625071 0.71 GCK (0.48) GCKALDH1A1LMNAUSP2MAPK1

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
WO-2012020357-A1 ACETAMIDE COMPOUNDS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION ADVINUS THERAPEUTICS LTD. (IN) 2012-02-16 WO disclosed