SCHEMBL15775973

SCHEMBL15775973

Cc1ccc(-c2nc3ncccc3c(=O)[nH]2)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TNKS O95271 12/20 0.62
TNKS2 Q9H2K2 12/20 0.62
PARP1 P09874 8/20 0.62
HCAR2 Q8TDS4 5/20 0.56
PARP2 Q9UGN5 3/20 0.47
AURKA O14965 2/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL15775288 0.85 TNKS (0.62) TNKSTNKS2PARP1HCAR2PARP2
SCHEMBL15775723 0.82 TNKS2 (0.65) TNKSTNKS2PARP1HCAR2PARP2
SCHEMBL30897311 0.79 HPGD (0.68) TNKSTNKS2PARP1HCAR2RAB9A
SCHEMBL11770396 0.78 AURKA (0.70) AURKARAB9ASMN1; SMN2
SCHEMBL6014115 0.78 HCAR2 (0.59) TNKS2PARP1HCAR2
SCHEMBL7765127 0.77 TNKS (1.00) TNKSTNKS2PARP1PARP2RAB9A
SCHEMBL29764113 0.77 TNKS (1.00) TNKSTNKS2PARP1PARP2RAB9A
SCHEMBL15775972 0.77 TNKS (0.51) TNKSTNKS2PARP1AURKARAB9A
SCHEMBL14344541 0.76 HCAR2 (0.56) TNKSTNKS2PARP1HCAR2PARP2
SCHEMBL16333375 0.76 HCAR2 (0.59) TNKSTNKS2PARP1HCAR2PARP2

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-2014087165-A1 TANKYRASE INHIBITORS UNIVERSITY OF BATH (GB) 2014-06-12 WO disclosed