SCHEMBL8307804

SCHEMBL8307804

C=CN1CCc2ccccc2C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.54
MAOB P27338 2/20 0.54
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
NOTUM Q6P988 1/20 0.44
TMPRSS2 O15393 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
CYP2D6 P10635 1/20 0.44
SLC6A2 P23975 1/20 0.44
DRD2 P14416 1/20 0.43
DRD1 P21728 1/20 0.43
DRD4 P21917 1/20 0.43
DRD5 P21918 1/20 0.43
DRD3 P35462 1/20 0.43
PHGDH O43175 1/20 0.43
MGLL Q99685 1/20 0.43
EED O75530 1/20 0.43

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
SCHEMBL18773853 0.84 ADRA1D (0.43) MAOAMAOBMEN1KMT2AMAPT
SCHEMBL30846758 0.84 ADRA1D (0.43) MAOAMAOBMEN1KMT2AMAPT
SCHEMBL56072 0.78 MAOA (0.54) MAOAMAOBMEN1KMT2AMAPT
SCHEMBL10520122 0.75 MAPT (0.37) MAOAMAOBMEN1KMT2AMAPT
SCHEMBL10519798 0.75 MAOA (0.32) MAOAMAOB
SCHEMBL7761447 0.75 MAOA (0.55) MAOAMAOBMEN1KMT2AMAPT
SCHEMBL3834171 0.75 MAOA (0.50) MAOAMAOBMEN1KMT2AMAPT
SCHEMBL22360347 0.75 SLC18A3 (0.50) MAOAMAOBSLC6A2GRIN2BSLC18A3
SCHEMBL6787188 0.74 MAOA (0.53) MAOAMAOBMEN1KMT2AMAPT
SCHEMBL7859402 0.74 MAOA (0.48) MAOAMAOBMEN1KMT2AMAPT

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
WO-2004087124-A1 COMPOUNDS HAVING SEROTONIN 5-HT17 RECEPTOR ANTAGONIST ACTIVITY AND MUSCARINIC M4 RECEPTOR AGONIST ACTIVITY AND THEIR USE IN THE TREATMENT OF PSYCHOTIC DISORDERS MITSUBISHI PHARMA CORPORATION (JP) 2004-10-14 WO disclosed