SCHEMBL8025232

SCHEMBL8025232

C[C@@H]1CN(C)[C@@H](C)c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.42
GPR3 P46089 1/20 0.38
CHRNB2 P17787 2/20 0.38
CHRNA4 P43681 2/20 0.38
PRCP P42785 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
MAOA P21397 1/20 0.35
HTR1A P08908 1/20 0.35
ROCK1 Q13464 1/20 0.35
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34

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
SCHEMBL8025229 1.00 NOTUM (0.42) NOTUMGPR3CHRNB2CHRNA4PRCP
SCHEMBL8011443 1.00 NOTUM (0.42) NOTUMGPR3CHRNB2CHRNA4PRCP
SCHEMBL8023208 1.00 NOTUM (0.42) NOTUMGPR3CHRNB2CHRNA4PRCP
SCHEMBL8027723 0.79 GPR3 (0.36) NOTUMGPR3CHRNB2CHRNA4PRCP
SCHEMBL19512601 0.77 NOTUM (0.41) NOTUMGPR3PRCPSLC6A2SLC6A4
SCHEMBL5245013 0.71 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3
SCHEMBL8023492 0.71 PRCP (0.61) PRCPDRD2DRD4MAOAHTR1A
SCHEMBL811761 0.71 PRCP (0.61) PRCPDRD2DRD4MAOAHTR1A
SCHEMBL8021507 0.71 PRCP (0.61) PRCPDRD2DRD4MAOAHTR1A
SCHEMBL13014907 0.71 GPR3 (0.46) GPR3PRCPSLC6A4SLC6A3

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