SCHEMBL7439628

SCHEMBL7439628

COc1cc2c(cc1OC)C(c1cccc([N+](=O)[O-])c1)=NN=C(C)C2

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 3/20 0.44
PDE4B Q07343 3/20 0.44
APP P05067 1/20 0.43
MAOB P27338 1/20 0.43
ACHE P22303 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
TDP2 O95551 3/20 0.41
MAPK10 P53779 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 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
SCHEMBL10886471 0.87 APP (0.51) PDE4BAPPMAOBACHEMEN1
SCHEMBL10884505 0.82 MAPT (0.47) APPMAOBACHEMEN1KMT2A
SCHEMBL7436927 0.81 PDE7A (0.46) MEN1KMT2AMAPK10ALDH1A1MAPT
SCHEMBL7410880 0.81 PDGFRB (0.49) PDE4DPDE4BMEN1KMT2AMAPK10
SCHEMBL10887682 0.80 CYP1A2 (0.47) MEN1KMT2AMAPK10ALDH1A1MAPT
SCHEMBL7431081 0.80 MAPK10 (0.52) PDE4BMEN1KMT2AMAPK10ALDH1A1
Girisopam SCHEMBL637118 0.80 MAPK10 (0.62) PDE4DMEN1KMT2AMAPK10ALDH1A1
SCHEMBL15985265 0.80 MAPK10 (0.52) MEN1KMT2AMAPK10ALDH1A1MAPT
Girisopam SCHEMBL8350989 0.80 MAPK10 (0.62) PDE4DMEN1KMT2AMAPK10ALDH1A1
SCHEMBL7606361 0.80 APP (0.43) PDE4BAPPMAOBACHEMEN1

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-4322346-A 5H-2,3-Benzodiazepine derivatives KOROSI JENO 1982-03-30 US disclosed