SCHEMBL3820193

SCHEMBL3820193

CN1c2cc(-c3ccncc3)ccc2CCN1C(=O)c1cc2ccc(Br)cn2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 8/20 0.36
CDC7 O00311 1/20 0.33
CDK9 P50750 1/20 0.33
CREBBP Q92793 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
ESR2 Q92731 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C18 P33260 1/20 0.32
CYP2C19 P33261 1/20 0.32
KCNH2 Q12809 1/20 0.32
ESR1 P03372 1/20 0.32
POLB P06746 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GPR142 Q7Z601 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL3818786 0.93 GRM5 (0.36) GRM5CREBBP
SCHEMBL3814607 0.89 GRM5 (0.36) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL3816502 0.89 GPR142 (0.35) GRM5CDC7CDK9CREBBPALDH1A1
SCHEMBL3813937 0.88 GRM5 (0.39) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL3822131 0.87 GRM5 (0.40) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL929612 0.86 GRM5 (0.52) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL3820015 0.85 ALDH1A1 (0.40) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL3813124 0.85 GRM5 (0.41) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL13719819 0.85 GRM5 (0.41) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL3819348 0.85 ALDH1A1 (0.39) GRM5ALDH1A1TDP1GAAMAPT

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