SCHEMBL7697609

SCHEMBL7697609

Fc1ccccc1Nc1cnc2cc3ccccc3cc2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 1/20 0.50
PDGFRB P09619 5/20 0.48
PDGFRA P16234 5/20 0.48
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
ALDH1A1 P00352 2/20 0.46
GAA P10253 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
AURKA O14965 1/20 0.44
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
RECQL P46063 1/20 0.40
MAPK8 P45983 1/20 0.39

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
SCHEMBL3909568 0.82 EGFR (0.57) MAPK10PDGFRBPDGFRANPC1RAB9A
SCHEMBL7696400 0.77 PDGFRB (0.76) PDGFRBPDGFRANPC1RAB9AALDH1A1
SCHEMBL7697848 0.76 PDGFRB (0.56) PDGFRBPDGFRANPC1RAB9AALDH1A1
SCHEMBL7694730 0.76 PDGFRB (0.59) MAPK10PDGFRBPDGFRANPC1RAB9A
SCHEMBL7699339 0.75 PDGFRB (0.46) PDGFRBPDGFRA
SCHEMBL31620733 0.73 NPC1 (0.71) MAPK10NPC1RAB9AALDH1A1GAA
SCHEMBL7695428 0.73 MAPKAPK2 (0.44) PDGFRBPDGFRAGAAKMT2AMAPT
SCHEMBL7690376 0.73 PDGFRB (0.49) PDGFRBPDGFRANPC1RAB9AGAA
SCHEMBL7696743 0.72 PDGFRB (0.59) MAPK10PDGFRBPDGFRANPC1RAB9A
SCHEMBL7695393 0.72 PDGFRB (0.59) MAPK10PDGFRBPDGFRANPC1RAB9A

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