SCHEMBL16309192

SCHEMBL16309192

Cc1cc(S(=O)(=O)C2CCN(C)CC2)ccc1-c1cc2cnc(Nc3ccc(C4CN(C)CCS4)cc3)nc2n(CC2CC2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 16/20 0.46
PAK4 O96013 2/20 0.44
PKN1 Q16512 2/20 0.44
PAK1 Q13153 1/20 0.41
WEE1 P30291 1/20 0.40
JAK3 P52333 1/20 0.39

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
SCHEMBL15036098 0.91 TNK2 (0.47) TNK2PAK4PKN1PAK1WEE1
SCHEMBL15041504 0.82 PKN1 (0.40) TNK2PAK4PKN1PAK1WEE1
SCHEMBL16309178 0.82 TNK2 (0.43) TNK2PAK4PKN1PAK1WEE1
SCHEMBL16309182 0.81 PAK4 (0.48) TNK2PAK4PKN1PAK1JAK3
SCHEMBL13553839 0.78 PAK1 (0.42) TNK2PAK4PKN1PAK1WEE1
SCHEMBL15041668 0.76 CDK4 (0.37) TNK2PAK4PKN1
SCHEMBL16309174 0.75 PAK1 (0.43) TNK2PAK1
SCHEMBL15036151 0.74 PAK4 (0.50) TNK2PAK4PKN1JAK3
SCHEMBL13554015 0.74 PAK1 (0.59) TNK2PAK4PKN1PAK1WEE1
SCHEMBL15785369 0.74 PKN1 (0.43) TNK2PAK4PKN1PAK1WEE1

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
US-8912203-B2 6-(sulfonylaryl)pyrido[2,3-D]pyrimidin-7(8H)-ones for the treatment of CNS disorders AFRAXIS HOLDINGS, INC. (US) 2014-12-16 US disclosed