SCHEMBL11082046

SCHEMBL11082046

CCC(C)SN(SC(C)CC)c1nc(N)nc(Cl)n1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.35

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
SCHEMBL11028987 0.88 GAA (0.33)
SCHEMBL11032177 0.83 PDE4A (0.38) PDE4A
SCHEMBL11029817 0.78
SCHEMBL11026561 0.76 PDE4A (0.38) PDE4A
SCHEMBL11031916 0.73 KMT2A (0.39) PDE4A
SCHEMBL11030468 0.73 PDE4A (0.41) PDE4A
SCHEMBL11027929 0.73 ALDH1A1 (0.36) PDE4A
SCHEMBL571829 0.71 PDE4A (0.37) PDE4A
SCHEMBL11081662 0.71 PDE4A (0.35) PDE4A
SCHEMBL11027875 0.70 PDE4A (0.34) PDE4A

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
US-4460769-A Thio-amino-1,3,5-triazines MONSANTO COMPANY (US) 1984-07-17 US disclosed
EP-0078784-A1 Thio-substituted-1,3,5-triazine-diamines and -triamines useful as prevulcanization inhibitors MONSANTO COMPANY (US) 1983-05-11 EP disclosed