SCHEMBL3814955

SCHEMBL3814955

CC1c2cccc([N+](=O)[O-])c2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
NCOA1 Q15788 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
GAA P10253 1/20 0.37
RECQL P46063 1/20 0.35
DRD1 P21728 1/20 0.34
CNR1 P21554 1/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MGLL Q99685 2/20 0.32
PGR P06401 1/20 0.32
ALKBH5 Q6P6C2 1/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32

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
SCHEMBL3817567 0.89 SMN1; SMN2 (0.39) HTTNCOA1SMN1; SMN2NCOA3ALDH1A1
SCHEMBL3812884 0.88 GAA (0.34) HTTNCOA1SMN1; SMN2NCOA3GAA
SCHEMBL3820067 0.87 DRD1 (0.42) HTTDRD1ALDH1A1MAPK1NPSR1
SCHEMBL3815643 0.86 MAPT (0.38) HTTDRD1ALDH1A1MAPK1NPSR1
SCHEMBL3813529 0.86 F11 (0.40) HTTDRD1ALDH1A1MAPK1NPSR1
SCHEMBL1010613 0.86 GRM5 (0.43) HTTNCOA1SMN1; SMN2NCOA3GAA
SCHEMBL3816988 0.85 F11 (0.39) DRD1MAPK1NPSR1
SCHEMBL3813174 0.84 HTT (0.47) HTTNCOA1SMN1; SMN2NCOA3GAA
SCHEMBL3818785 0.84 DRD1 (0.36) DRD1ALDH1A1MAPK1NPSR1MGLL
SCHEMBL3816076 0.83 HTT (0.46) HTTNCOA1SMN1; SMN2NCOA3GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2090576-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) 2009-08-19 EP claimed
EP-2090576-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) 2009-08-19 EP disclosed
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