SCHEMBL15775404

SCHEMBL15775404

COc1ccc(-c2nc(=O)c3cccc(OC)c3[nH]2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 12/20 0.64
TNKS2 Q9H2K2 12/20 0.64
PARP1 P09874 6/20 0.64
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
GUSB P08236 1/20 0.54
CASP3 P42574 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
PARP2 Q9UGN5 6/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ADORA2B P29275 1/20 0.48
CYP1A1 P04798 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP1B1 Q16678 1/20 0.47
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
PKM P14618 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
SCHEMBL15775468 0.89 TNKS (0.64) TNKSTNKS2PARP1PARP2MEN1
SCHEMBL15775359 0.89 TNKS (0.64) TNKSTNKS2PARP1PARP2MEN1
SCHEMBL15775406 0.89 TNKS (0.63) TNKSTNKS2PARP1NPC1RAB9A
SCHEMBL15775408 0.88 TNKS (0.65) TNKSTNKS2PARP1PARP2MEN1
SCHEMBL15775271 0.88 TNKS (0.65) TNKSTNKS2PARP1PARP2MEN1
SCHEMBL15775172 0.88 TNKS (0.65) TNKSTNKS2PARP1GUSBPARP2
SCHEMBL15775351 0.86 TNKS (0.64) TNKSTNKS2PARP1NPC1RAB9A
SCHEMBL15775334 0.85 TNKS (0.67) TNKSTNKS2PARP1RAB9APARP2
SCHEMBL15775263 0.84 TNKS (0.68) TNKSTNKS2PARP1NPC1RAB9A
SCHEMBL7673043 0.79 KDM4E (0.64) TNKSTNKS2PARP1NPC1RAB9A

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