SCHEMBL3811200

SCHEMBL3811200

CN1c2cccc(Br)c2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.35
F11 P03951 3/20 0.34
KLKB1 P03952 3/20 0.34
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 3/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
AKT1 P31749 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
TACR2 P21452 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
SCHEMBL3815748 0.91 NOTUM (0.41) GRM5MAPK1NPSR1KDM4EALDH1A1
SCHEMBL3815573 0.90 NOTUM (0.39) GRM5MAPK1NPSR1KDM4EALDH1A1
SCHEMBL3818411 0.90 GRM5 (0.40) GRM5SMN1; SMN2ALDH1A1TSHRLMNA
SCHEMBL3821315 0.89 NOTUM (0.40) GRM5F11KLKB1MAPK1NPSR1
SCHEMBL3819674 0.87 NOTUM (0.42) F11KLKB1NPSR1KDM4EALDH1A1
SCHEMBL3815438 0.87 NOTUM (0.43) MAPK1SMN1; SMN2ALDH1A1TSHRLMNA
SCHEMBL3812606 0.87 CCKBR (0.31) GRM5MAPK1NPSR1KDM4EALDH1A1
SCHEMBL3819666 0.86 GRM5 (0.36) GRM5MAPK1NPSR1SMN1; SMN2KDM4E
SCHEMBL3812674 0.86 F11 (0.37) F11KLKB1KDM4EALDH1A1LMNA
SCHEMBL13720475 0.85 NOTUM (0.40) GRM5ALDH1A1TSHRMAPTAKT1

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