SCHEMBL8538175

SCHEMBL8538175

c1ccc2nc3cc(N=NC4CCCCC4)ccc3nc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 5/20 0.37
MAPT P10636 5/20 0.35
MEN1 O00255 3/20 0.35
NPC1 O15118 3/20 0.35
KMT2A Q03164 3/20 0.35
POLB P06746 2/20 0.35
CACNA1B Q00975 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
USP2 O75604 1/20 0.35
APBA1 Q02410 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
ALDH1A1 P00352 4/20 0.34
RAB9A P51151 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
KDM4E B2RXH2 3/20 0.34
LMNA P02545 2/20 0.34
PDE5A O76074 1/20 0.32
MAPK1 P28482 1/20 0.32
EPHX1 P07099 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL24208239 0.74 ALDH1A1 (0.46) MAPTMEN1NPC1KMT2ASMN1; SMN2
SCHEMBL22651703 0.74 ALDH1A1 (0.46) MAPTMEN1NPC1KMT2ASMN1; SMN2
SCHEMBL3682182 0.66 NQO2 (0.50) NQO2MAPTMEN1NPC1KMT2A
SCHEMBL8820259 0.66 NQO2 (0.50) NQO2MAPTMEN1NPC1KMT2A
SCHEMBL10455960 0.63 ALDH1A1 (0.52) MAPTMEN1NPC1KMT2APOLB
SCHEMBL14337206 0.62 FAAH (0.40) NPC1ALDH1A1RAB9AKDM4E
SCHEMBL3363930 0.62 TOP2A (0.39) NQO2MAPTMEN1NPC1KMT2A
SCHEMBL3363928 0.62 TOP2A (0.39) NQO2MAPTMEN1NPC1KMT2A
SCHEMBL4612924 0.61 MAPT (0.79) NQO2MAPTMEN1NPC1KMT2A
SCHEMBL13156546 0.61 MAPT (0.79) NQO2MAPTMEN1NPC1KMT2A

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-5763442-A PHENAZINE AS ANTIMALERIA AGENTS UNIVERSITEIT VAN PRETORIA (ZA) 1998-06-09 US disclosed