SCHEMBL8557316

SCHEMBL8557316

Cc1c(OC(=O)O)nc2c(=O)[nH]c3ccc(OCC(C)C)cc3n12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.41
ADORA3 P0DMS8 7/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
MAOA P21397 1/20 0.35
TRIM24 O15164 1/20 0.35
TARBP2 Q15633 1/20 0.34
MEN1 O00255 1/20 0.34
MC4R P32245 1/20 0.34
KMT2A Q03164 1/20 0.34
PAX8 Q06710 1/20 0.34
CHEK1 O14757 1/20 0.34
DAPK3 O43293 1/20 0.34
PRKD3 O94806 1/20 0.34
MET P08581 1/20 0.34
PDGFRA P16234 1/20 0.34
FLT1 P17948 1/20 0.34
LTK P29376 1/20 0.34

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
SCHEMBL8558735 0.90 ADORA3 (0.40) XDHADORA3KDM4EALDH1A1LMNA
SCHEMBL8557884 0.81 ADORA3 (0.49) ADORA3KDM4EALDH1A1POLBCHEK1
SCHEMBL8557815 0.80 DAO (0.39) ADORA3KDM4EALDH1A1LMNACHEK1
SCHEMBL8552666 0.78 PDE9A (0.38) ADORA3CHEK1DAPK3PRKD3MET
SCHEMBL8553821 0.78 POLB (0.49) ADORA3KDM4EALDH1A1POLBMEN1
SCHEMBL8557905 0.78 GRIN2D (0.43) ADORA3CHEK1DAPK3PRKD3MET
SCHEMBL8553189 0.77 CHEK1 (0.43) ADORA3KDM4EALDH1A1POLBMEN1
SCHEMBL8553450 0.76 GRIA1 (0.49) LMNACHEK1DAPK3PRKD3MET
SCHEMBL8557421 0.75 EGLN1 (0.38) ADORA3KDM4EPOLBKMT2ACHEK1
SCHEMBL8559120 0.74 ADORA3 (0.50) ADORA3

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
EP-0691970-B1 IMIDAZOLOQUINOXALINONE DERIVATIVES AS EAA ANTAGONISTS BASF AG (DE) 1998-11-11 EP disclosed