SCHEMBL17833265

SCHEMBL17833265

Cc1cccc(-c2cccc(-c3nc4c(C)cccc4c(=O)[nH]3)c2)c1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TNKS O95271 15/20 0.72
TNKS2 Q9H2K2 15/20 0.72
PARP1 P09874 12/20 0.72
NPC1 O15118 1/20 0.65
RAB9A P51151 1/20 0.65
PARP2 Q9UGN5 4/20 0.64
PBRM1 Q86U86 1/20 0.51

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
SCHEMBL17833160 0.87 TNKS (0.68) TNKSTNKS2PARP1NPC1RAB9A
SCHEMBL17829660 0.87 TNKS (0.72) TNKSTNKS2PARP1NPC1RAB9A
SCHEMBL17829758 0.86 TNKS (0.70) TNKSTNKS2PARP1NPC1RAB9A
SCHEMBL17833163 0.85 TNKS (0.69) TNKSTNKS2PARP1PARP2
SCHEMBL17829754 0.85 TNKS (0.69) TNKSTNKS2PARP1PARP2
SCHEMBL15775476 0.84 TNKS (1.00) TNKSTNKS2PARP1PARP2
SCHEMBL17833266 0.84 TNKS (0.64) TNKSTNKS2PARP1NPC1RAB9A
SCHEMBL17829691 0.84 TNKS (0.76) TNKSTNKS2PARP1NPC1RAB9A
SCHEMBL17829756 0.84 TNKS (0.74) TNKSTNKS2PARP1PARP2
SCHEMBL15775325 0.83 TNKS (1.00) TNKSTNKS2PARP1PARP2

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