SCHEMBL8024193

SCHEMBL8024193

CC1c2cc(Br)ccc2CCN1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.56
HTR2A P28223 2/20 0.49
HTR2C P28335 2/20 0.49
HTR2B P41595 2/20 0.49
PLAU P00749 1/20 0.44
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
ASIC3 Q9UHC3 1/20 0.42
DRD2 P14416 1/20 0.39
PRCP P42785 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
NFKB1 P19838 1/20 0.38
HIF1A Q16665 1/20 0.38
ADRA2A P08913 1/20 0.37
PNMT P11086 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37

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
SCHEMBL8011243 0.86 MAOA (0.56) MAOAHTR2AHTR2CHTR2BPLAU
SCHEMBL18100258 0.82 OPRM1 (0.45) MAOAHTR2AHTR2CHTR2BOPRM1
SCHEMBL8023881 0.81 MAOA (0.57) MAOAHTR2CHTR2BPLAUOPRM1
SCHEMBL29557733 0.79 MAOA (0.56) MAOAHTR2APLAUASIC3DRD2
SCHEMBL7655001 0.79 MAOA (0.56) MAOAHTR2APLAUASIC3DRD2
SCHEMBL8012740 0.79 MAOA (0.56) MAOAHTR2AHTR2CPLAUASIC3
SCHEMBL8028684 0.79 MAOA (0.56) MAOAHTR2AHTR2CHTR2BPLAU
SCHEMBL8029002 0.79 MAOA (0.56) MAOAHTR2AHTR2CPLAUASIC3
SCHEMBL31536303 0.79 ASIC3 (0.48) HTR2AHTR2CHTR2BPLAUOPRM1
SCHEMBL8032032 0.79 MAOA (0.64) MAOAHTR2AHTR2CPLAUDRD2

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-2009095253-A1 6-HALO-PYRAZOLO[1, 5-A]PYRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR (MGLUR) MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2009-08-06 WO disclosed