SCHEMBL29903456

SCHEMBL29903456

Nc1ccc2nc3ccccc3nc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.67
TLR9 Q9NR96 2/20 0.67
ATM Q13315 2/20 0.67
HTR3A P46098 1/20 0.65
MAPT P10636 5/20 0.65
MEN1 O00255 4/20 0.65
NPC1 O15118 3/20 0.65
POLB P06746 2/20 0.65
USP2 O75604 1/20 0.65
CACNA1B Q00975 1/20 0.65
APBA1 Q02410 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
LMNA P02545 2/20 0.58
HTT P42858 2/20 0.58
F2 P00734 1/20 0.58
CHRM2 P08172 1/20 0.58
HTR1A P08908 1/20 0.58
ADRA2A P08913 1/20 0.58
ADORA3 P0DMS8 1/20 0.58
MAOA P21397 1/20 0.58

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
SCHEMBL5803173 1.00 KMT2A (0.67) KMT2ATLR9ATMHTR3AMAPT
SCHEMBL3480837 0.92 KMT2A (0.67) KMT2ATLR9ATMHTR3AMAPT
SCHEMBL4586206 0.92 KMT2A (0.67) KMT2ATLR9ATMHTR3AMAPT
SCHEMBL29922808 0.92 KMT2A (0.67) KMT2ATLR9ATMHTR3AMAPT
Hydrochloric Acid SCHEMBL7566148 0.90 KMT2A (0.64) KMT2ATLR9ATMHTR3AMAPT
SCHEMBL4947370 0.81 KMT2A (0.56) KMT2ATLR9ATMHTR3AMAPT
SCHEMBL11792682 0.81 KMT2A (1.00) KMT2ATLR9ATMMAPTMEN1
SCHEMBL4063489 0.80 KMT2A (0.47) KMT2ATLR9ATMHTR3AMAPT
SCHEMBL30076611 0.79 HTR3A (0.77) KMT2ATLR9ATMHTR3AMAPT
SCHEMBL1230201 0.79 HTR3A (0.77) KMT2ATLR9ATMHTR3AMAPT

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
CN-113121458-B Method for rapidly synthesizing 2, 3-diaminophenazine by ultrasonic radiation catalysis 河南科技大学 2022-08-23 CN disclosed