SCHEMBL5244451

SCHEMBL5244451

CN(c1ccccc1)c1ncnc(Cl)c1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
CSF1R P07333 6/20 0.47
EGFR P00533 4/20 0.47
LMNA P02545 2/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
HTT P42858 1/20 0.45
CYP3A4 P08684 2/20 0.43
CYP1A2 P05177 1/20 0.42
ALDH1A1 P00352 1/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
ABCG2 Q9UNQ0 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
SCHEMBL5247652 0.87 MAPT (0.47) MAPTCSF1REGFRLMNAKMT2A
SCHEMBL5244192 0.86 MAPT (0.43) MAPTCSF1REGFRLMNAKMT2A
SCHEMBL17815794 0.85 MAPT (0.43) MAPTCSF1RLMNAKMT2AMEN1
SCHEMBL2019674 0.84 CA1 (0.43) MAPTCSF1REGFRLMNAKMT2A
SCHEMBL17815790 0.82 PRMT1 (0.43) MAPTLMNAKMT2AMEN1HTT
SCHEMBL9124886 0.80 HTT (0.64) MAPTCSF1REGFRLMNAKMT2A
SCHEMBL8078419 0.80 LMNA (0.40) MAPTLMNAKMT2AMEN1HTT
SCHEMBL12459324 0.80 LMNA (0.73) MAPTCSF1RLMNAKMT2AMEN1
SCHEMBL14797801 0.76 LMNA (0.54) MAPTLMNAKMT2AMEN1HTT
SCHEMBL5244332 0.74 EGFR (0.53) MAPTCSF1REGFRKMT2AMEN1

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
EP-1848506-A2 PYRIMIDINE-FUSED DIAZEPINE DERIVATIVES AND INDOLE-FUSED PTERIDINES Attenuon, LLC (US) 2007-10-31 EP disclosed
WO-2006089298-A2 PYRIMIDINE-FUSED DIAZEPINE DERIVATIVES AND INDOLE-FUSED PTERIDINES ATTENUON, LLC (US) 2006-08-24 WO disclosed