SCHEMBL8028909

SCHEMBL8028909

CC1c2cc(N3CCOCC3)ccc2CCN1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.53
OPRM1 P35372 1/20 0.53
MAOA P21397 3/20 0.49
TMEM97 Q5BJF2 5/20 0.43
SIGMAR1 Q99720 5/20 0.43
ADRA2A P08913 2/20 0.43
ADRA2B P18089 2/20 0.43
DRD4 P21917 1/20 0.43
HRH1 P35367 1/20 0.43
HTR2B P41595 1/20 0.43
LGMN Q99538 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 3/20 0.41
HSD17B10 Q99714 2/20 0.41
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL8019057 0.88 OPRM1 (0.50) OPRD1OPRM1MAOATMEM97SIGMAR1
SCHEMBL8026503 0.86 MAOA (0.53) OPRD1OPRM1MAOAALDH1A1MEN1
SCHEMBL8024961 0.85 MAOA (0.51) OPRD1OPRM1MAOAALDH1A1MEN1
SCHEMBL1011361 0.77 OPRM1 (0.48) OPRD1OPRM1MAOATMEM97SIGMAR1
SCHEMBL8018986 0.76 HPGD (0.50) MAOAALDH1A1MAPTKMT2AHTT
SCHEMBL8023881 0.74 MAOA (0.57) OPRM1MAOAHTR2BMEN1KMT2A
SCHEMBL8028683 0.74 TMEM97 (0.56) MAOATMEM97SIGMAR1ADRA2AADRA2B
SCHEMBL8024193 0.73 MAOA (0.56) OPRD1OPRM1MAOAADRA2AADRA2B
SCHEMBL8028684 0.73 MAOA (0.56) MAOAADRA2AADRA2BHRH1HTR2B
SCHEMBL8012740 0.73 MAOA (0.56) MAOAKMT2APLAUSLC6A4

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