SCHEMBL11030468

SCHEMBL11030468

CSN(SC)c1nc(N)nc(Cl)n1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.41
HSP90AA1 P07900 2/20 0.32

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
SCHEMBL11026801 0.84 ALDH1A1 (0.35)
SCHEMBL11026561 0.79 PDE4A (0.38) PDE4AHSP90AA1
SCHEMBL11032177 0.79 PDE4A (0.38) PDE4A
SCHEMBL11031916 0.76 KMT2A (0.39) PDE4A
SCHEMBL15381134 0.76 PDE4A (0.47) PDE4AHSP90AA1
SCHEMBL29391673 0.76 PDE4A (0.47) PDE4AHSP90AA1
SCHEMBL11082046 0.73 PDE4A (0.35) PDE4A
SCHEMBL11081662 0.73 PDE4A (0.35) PDE4A
SCHEMBL11027875 0.72 PDE4A (0.34) PDE4A
SCHEMBL11027980 0.71 SMN1; SMN2 (0.35) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0078784-B1 THIO-SUBSTITUTED-1,3,5-TRIAZINE-DIAMINES AND -TRIAMINES USEFUL AS PREVULCANIZATION INHIBITORS MONSANTO COMPANY (US) 1985-07-03 EP disclosed
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