SCHEMBL17833232

SCHEMBL17833232

Cc1cc(F)cc(-c2ccc(-c3nc4c(C)cccc4c(=O)[nH]3)cc2)c1

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TNKS O95271 17/20 0.75
TNKS2 Q9H2K2 17/20 0.75
PARP2 Q9UGN5 5/20 0.75
PARP1 P09874 13/20 0.70

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
SCHEMBL17829785 0.86 TNKS (0.75) TNKSTNKS2PARP2PARP1
SCHEMBL15775474 0.86 TNKS (1.00) TNKSTNKS2PARP2PARP1
SCHEMBL15775325 0.83 TNKS (1.00) TNKSTNKS2PARP2PARP1
SCHEMBL17833234 0.80 TNKS (0.73) TNKSTNKS2PARP2PARP1
SCHEMBL17829738 0.80 TNKS (0.72) TNKSTNKS2PARP2PARP1
SCHEMBL17833163 0.80 TNKS (0.69) TNKSTNKS2PARP2PARP1
SCHEMBL15775476 0.79 TNKS (1.00) TNKSTNKS2PARP2PARP1
SCHEMBL17829761 0.79 TNKS (0.67) TNKSTNKS2PARP2PARP1
SCHEMBL17833265 0.79 TNKS (0.72) TNKSTNKS2PARP2PARP1
SCHEMBL17831874 0.79 TNKS (0.63) TNKSTNKS2PARP2PARP1

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-2016094730-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS SYNERECA PHARMACEUTICALS, INC. (US) 2016-06-16 WO disclosed