SCHEMBL17153755

SCHEMBL17153755

c1cnc2nnc(SSc3nnc4ncccn34)n2c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.49
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
BACE1 P56817 2/20 0.42
ALDH1A1 P00352 10/20 0.41
PKM P14618 2/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 5/20 0.38
KDM4E B2RXH2 9/20 0.38
GLA P06280 2/20 0.38
RAB9A P51151 2/20 0.38
PDE10A Q9Y233 1/20 0.36
HSD17B10 Q99714 2/20 0.33
KLK7 P49862 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 2/20 0.32
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL18879011 0.74 PKM (0.41) HPGDHTTSMN1; SMN2BACE1ALDH1A1
SCHEMBL3200251 0.72 BACE1 (0.39) HPGDHTTSMN1; SMN2BACE1ALDH1A1
SCHEMBL22714820 0.72 BACE1 (0.39) HPGDHTTSMN1; SMN2BACE1ALDH1A1
SCHEMBL8646557 0.72 HPGD (0.40) HPGDHTTSMN1; SMN2BACE1ALDH1A1
SCHEMBL10758387 0.72 HPGD (0.40) HPGDHTTSMN1; SMN2BACE1ALDH1A1
SCHEMBL30498959 0.71 GAA (0.45) HPGDSMN1; SMN2BACE1ALDH1A1GAA
SCHEMBL2022590 0.69 BACE1 (0.57) HPGDHTTSMN1; SMN2BACE1ALDH1A1
SCHEMBL14048226 0.68 ALDH1A1 (0.40) HPGDHTTSMN1; SMN2BACE1ALDH1A1
SCHEMBL14030342 0.68 BACE1 (0.36) HPGDHTTSMN1; SMN2BACE1ALDH1A1
SCHEMBL18879010 0.68 PKM (0.40) HPGDHTTSMN1; SMN2BACE1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150287953-A1 TRANSPARENT ELECTRODE, ELECTRONIC DEVICE, AND ORGANIC ELECTROLUMINESCENT ELEMENT Konica Minolta, Inc. (JP) 2015-10-08 US disclosed
US-20150287953-A1 TRANSPARENT ELECTRODE, ELECTRONIC DEVICE, AND ORGANIC ELECTROLUMINESCENT ELEMENT Konica Minolta, Inc. (JP) 2015-10-08 US disclosed