SCHEMBL15775259

SCHEMBL15775259

O=c1[nH]c(-c2ccc(Cl)cc2)nc2ccncc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 10/20 0.67
TNKS2 Q9H2K2 10/20 0.67
PARP2 Q9UGN5 3/20 0.67
GUSB P08236 2/20 0.67
HPGD P15428 4/20 0.64
ALDH1A1 P00352 3/20 0.64
KDM4E B2RXH2 1/20 0.64
NPC1 O15118 1/20 0.64
PKM P14618 1/20 0.64
RAB9A P51151 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
KDM4C Q9H3R0 4/20 0.61
PDE10A Q9Y233 1/20 0.57
MAPT P10636 2/20 0.56
ALOX15 P16050 1/20 0.56
HSD17B10 Q99714 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56
PARP1 P09874 6/20 0.51
TSHR P16473 1/20 0.51
CYP1A1 P04798 1/20 0.48

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
SCHEMBL20299026 0.88 HPGD (0.71) TNKSTNKS2PARP2GUSBHPGD
SCHEMBL14344516 0.86 KDM4C (0.80) TNKSTNKS2PARP2GUSBHPGD
SCHEMBL15775258 0.85 TNKS (0.67) TNKSTNKS2GUSBHPGDALDH1A1
SCHEMBL11080745 0.80 TNKS (0.73) TNKSTNKS2PARP2GUSBHPGD
SCHEMBL8618931 0.80 TNKS (1.00) TNKSTNKS2PARP2GUSBHPGD
SCHEMBL9694046 0.78 ALDH1A1 (1.00) HPGDALDH1A1KDM4ENPC1PKM
SCHEMBL15775257 0.77 ALDH1A1 (0.60) TNKSTNKS2PARP2GUSBHPGD
SCHEMBL14344501 0.76 KDM4C (1.00) TNKSTNKS2PARP2GUSBHPGD
SCHEMBL11083849 0.75 TNKS (0.65) TNKSTNKS2PARP2GUSBNPC1
SCHEMBL15645718 0.75 KDM4C (0.82) TNKSTNKS2GUSBHPGDALDH1A1

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