SCHEMBL3821083

SCHEMBL3821083

CN1c2ccccc2CCN1C(=O)c1cc2c([N+](=O)[O-])cc(Cl)cn2n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 5/20 0.38
MAPK1 P28482 4/20 0.38
ALDH1A1 P00352 3/20 0.38
PKM P14618 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HPGD P15428 1/20 0.36
RECQL P46063 1/20 0.35
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL3820182 0.89 SMN1; SMN2 (0.41) GAAMEN1KMT2AMAPTMAPK1
SCHEMBL3819023 0.86 SPR (0.41) GAAMAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL3817222 0.83 ALDH1A1 (0.40) GAAKMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL3813373 0.82 GAA (0.60) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL3815336 0.80 GAA (0.44) GAAMAPTMAPK1ALDH1A1PKM
SCHEMBL3816553 0.80 GAA (0.44) GAAMAPTMAPK1ALDH1A1PKM
SCHEMBL3813190 0.79 SMN1; SMN2 (0.39) GAAALDH1A1SMN1; SMN2LMNA
SCHEMBL930149 0.79 GRM5 (0.48) GAAMAPTALDH1A1SMN1; SMN2HPGD
SCHEMBL3824171 0.77 SMN1; SMN2 (0.45) GAAALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL3816897 0.74 ALDH1A1 (0.40) GAAKMT2AALDH1A1SMN1; SMN2LMNA

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 4 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
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