SCHEMBL9099360

SCHEMBL9099360

O=[N+]([O-])c1ccc(NO)c2nonc12

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.64
KMT2A Q03164 11/20 0.64
MYC P01106 7/20 0.64
IDO1 P14902 4/20 0.64
POLB P06746 1/20 0.63
GAA P10253 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
MAX P61244 3/20 0.60
GSTM2 P28161 1/20 0.60
USP2 O75604 1/20 0.59
HTT P42858 1/20 0.59
RECQL P46063 1/20 0.59
MAPT P10636 2/20 0.57
PSMD14 O00487 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
MIF P14174 1/20 0.56
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
OPRK1 P41145 1/20 0.53

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
SCHEMBL8788690 0.85 MEN1 (0.66) MEN1KMT2AMYCIDO1POLB
SCHEMBL7052057 0.84 GSTM2 (0.66) MEN1KMT2AMYCIDO1POLB
SCHEMBL27934659 0.83 MEN1 (0.64) MEN1KMT2AMYCIDO1POLB
SCHEMBL612306 0.83 IDO1 (0.65) MEN1KMT2AMYCIDO1POLB
SCHEMBL593192 0.83 MEN1 (0.64) MEN1KMT2AMYCIDO1POLB
SCHEMBL7904806 0.83 MEN1 (0.64) MEN1KMT2AMYCIDO1POLB
Hydrazine SCHEMBL28939827 0.82 MEN1 (0.62) MEN1KMT2AMYCIDO1POLB
SCHEMBL3506039 0.81 MEN1 (0.64) MEN1KMT2AMYCIDO1POLB
SCHEMBL14266890 0.81 MEN1 (0.61) MEN1KMT2AMYCIDO1POLB
SCHEMBL8427049 0.80 GSTM2 (0.81) MEN1KMT2AMYCIDO1POLB

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-1993003382-A2 CHARACTERIZATION OF SPECIFIC DRUG RECEPTORS WITH FLUORESCENT LIGANDS PHARMACEUTICAL DISCOVERY CORPORATION (US) 1993-02-18 WO claimed
US-5576436-A FLUORESCENT LABELED LIGANDS FOR MEASUREMENT OF RECEPTORS PHARMACEUTICAL DISCOVERY CORPORATION (US) 1996-11-19 US disclosed