SCHEMBL5590610

SCHEMBL5590610

c1ccc(-c2nnc(-c3ccccn3)c(-c3ccccc3)n2)cc1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.62
HIF1A Q16665 12/20 0.61
KDM4E B2RXH2 4/20 0.61
LMNA P02545 4/20 0.61
MITF O75030 1/20 0.61
HTT P42858 3/20 0.57
ALDH1A1 P00352 1/20 0.56
MAPT P10636 1/20 0.56
TP53 P04637 1/20 0.52
HSP90AA1 P07900 1/20 0.49
SLC2A1 P11166 1/20 0.49
KMT2A Q03164 1/20 0.49
NCOA1 Q15788 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL5590717 0.95 HIF1A (0.59) SMN1; SMN2HIF1AKDM4ELMNAMITF
SCHEMBL5590017 0.93 HIF1A (0.66) SMN1; SMN2HIF1AKDM4ELMNAMITF
SCHEMBL5590434 0.93 SMN1; SMN2 (0.62) SMN1; SMN2HIF1AKDM4ELMNAMITF
SCHEMBL149565 0.88 HIF1A (0.68) SMN1; SMN2HIF1AKDM4ELMNAMITF
SCHEMBL30272734 0.88 HIF1A (0.68) SMN1; SMN2HIF1AKDM4ELMNAMITF
SCHEMBL5590746 0.86 HIF1A (0.66) SMN1; SMN2HIF1AKDM4ELMNAMITF
SCHEMBL5590833 0.82 TP53 (0.65) SMN1; SMN2HIF1AKDM4ELMNAMITF
SCHEMBL3445210 0.81 SMN1; SMN2 (0.81) SMN1; SMN2KDM4ELMNAALDH1A1MAPT
SCHEMBL23543006 0.81 KDM4E (0.53) SMN1; SMN2HIF1AKDM4ELMNAMITF
SCHEMBL32668864 0.79 ALDH1A1 (0.81) SMN1; SMN2KDM4ELMNAALDH1A1MAPT

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
US-20070020519-A1 Anode active material, manufacturing method thereof and lithium battery using the anode active material SAMSUNG SDI CO., LTD. (KR) 2007-01-25 US disclosed