SCHEMBL7690215

SCHEMBL7690215

Clc1ccc(Nc2nc3cc4ccccc4cc3nc2-c2cccs2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KB2 Q9UBS0 6/20 0.60
MAPT P10636 4/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PGK1 P00558 1/20 0.46
PDE5A O76074 2/20 0.43
POLB P06746 1/20 0.43
SRPK1 Q96SB4 1/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 2/20 0.42
GBA1 P04062 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM1A O60341 1/20 0.40

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
SCHEMBL6237808 0.91 KMT2A (0.49) RPS6KB2MAPTKDM4EALDH1A1KMT2A
SCHEMBL7697783 0.88 RPS6KB2 (0.57) RPS6KB2MAPTKDM4EALDH1A1KMT2A
SCHEMBL7695652 0.87 RPS6KB2 (0.60) RPS6KB2MAPTKDM4EALDH1A1KMT2A
SCHEMBL7695845 0.85 RPS6KB2 (0.57) RPS6KB2MAPTKDM4EALDH1A1KMT2A
SCHEMBL7696931 0.83 RPS6KB2 (0.55) RPS6KB2MAPTKDM4EALDH1A1KMT2A
SCHEMBL7692003 0.82 RPS6KB2 (0.53) RPS6KB2MAPTKDM4EALDH1A1KMT2A
SCHEMBL7697772 0.81 RPS6KB2 (0.58) RPS6KB2MAPTKDM4EALDH1A1KMT2A
SCHEMBL7694559 0.80 RPS6KB2 (0.51) RPS6KB2MAPTKDM4EALDH1A1KMT2A
SCHEMBL7696783 0.80 NPY5R (0.51) MAPTKDM4EALDH1A1KMT2ANPC1
SCHEMBL7691382 0.80 ABCG2 (0.61) RPS6KB2MAPTKDM4EALDH1A1KMT2A

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
WO-2002094796-A2 BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES AXXIMA PHARMACEUTICALS AG (DE) 2002-11-28 WO claimed
WO-2002094796-A2 BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES AXXIMA PHARMACEUTICALS AG (DE) 2002-11-28 WO disclosed