SCHEMBL15775359

SCHEMBL15775359

COc1cccc2c(=O)nc(-c3ccc(C)cc3)[nH]c12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 15/20 0.64
TNKS2 Q9H2K2 15/20 0.64
PARP1 P09874 8/20 0.64
PARP2 Q9UGN5 6/20 0.51
NQO2 P16083 1/20 0.49
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
POLB P06746 2/20 0.45
MAPT P10636 2/20 0.45
KMT2A Q03164 2/20 0.45
MCL1 Q07820 2/20 0.45
LMNA P02545 1/20 0.45
BLM P54132 1/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
HTT P42858 1/20 0.45
RECQL P46063 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL15775468 0.89 TNKS (0.64) TNKSTNKS2PARP1PARP2NQO2
SCHEMBL15775404 0.89 TNKS (0.64) TNKSTNKS2PARP1PARP2NQO2
SCHEMBL15775406 0.89 TNKS (0.63) TNKSTNKS2PARP1PARP2NQO2
SCHEMBL15775172 0.88 TNKS (0.65) TNKSTNKS2PARP1PARP2NQO2
SCHEMBL15775271 0.88 TNKS (0.65) TNKSTNKS2PARP1PARP2NQO2
SCHEMBL15775408 0.88 TNKS (0.65) TNKSTNKS2PARP1PARP2NQO2
SCHEMBL15775334 0.85 TNKS (0.67) TNKSTNKS2PARP1PARP2KDM4E
SCHEMBL15775263 0.84 TNKS (0.68) TNKSTNKS2PARP1PARP2MEN1
SCHEMBL15775324 0.83 TNKS (0.61) TNKSTNKS2PARP1PARP2KDM4E
SCHEMBL15775691 0.81 TNKS (0.63) TNKSTNKS2PARP1KDM4E

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