SCHEMBL8735294

SCHEMBL8735294

CCNC(=S)C(=S)N(O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
CYP3A4 P08684 1/20 0.46
KDM4A O75164 1/20 0.40
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA9 Q16790 1/20 0.31
EHMT2 Q96KQ7 1/20 0.31
EHMT1 Q9H9B1 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
SCHEMBL3062029 0.76 ALDH1A1 (0.62) ALDH1A1CYP3A4KDM4ACA12CA1
SCHEMBL3075815 0.69
SCHEMBL16709986 0.67
SCHEMBL3062032 0.65 ALDH1A1 (0.48) ALDH1A1CYP3A4KDM4ACA1CA9
SCHEMBL1400059 0.65
SCHEMBL80644 0.64
SCHEMBL12832728 0.63
SCHEMBL3081731 0.63
SCHEMBL24760539 0.62
SCHEMBL25062604 0.62

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-0820492-A1 EPOXY ADHESIVES WITH DITHIOOXAMIDE ADHESION PROMOTERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-01-28 EP disclosed
WO-1996032454-A1 EPOXY ADHESIVES WITH DITHIOOXAMIDE ADHESION PROMOTERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-10-17 WO disclosed