SCHEMBL3819764

SCHEMBL3819764

CC1c2ccc3c(c2CCN1C(=O)c1cc2ccc(Cl)cn2n1)CCCN3C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PROKR1 Q8TCW9 2/20 0.34
KLKB1 P03952 4/20 0.33
F11 P03951 1/20 0.33
GRM5 P41594 4/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
RORC P51449 1/20 0.31
MGLL Q99685 3/20 0.31
KCNH2 Q12809 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
SCHEMBL3812787 0.89 TNKS (0.37) GRM5ALDH1A1LMNATSHRTP53
SCHEMBL1010374 0.86 GRM5 (0.43) MAPK1NPSR1GRM5ALDH1A1LMNA
SCHEMBL3815643 0.84 MAPT (0.38) MAPK1NPSR1PROKR1GRM5ALDH1A1
SCHEMBL3819163 0.83 MAPK1 (0.33) MAPK1NPSR1PROKR1MGLL
SCHEMBL3820067 0.83 DRD1 (0.42) MAPK1NPSR1KLKB1F11GRM5
SCHEMBL3813529 0.82 F11 (0.40) MAPK1NPSR1KLKB1F11GRM5
SCHEMBL3816988 0.81 F11 (0.39) MAPK1NPSR1KLKB1F11GRM5
SCHEMBL3818785 0.80 DRD1 (0.36) MAPK1NPSR1KLKB1F11GRM5
SCHEMBL3817040 0.80 MAPK1 (0.34) MAPK1NPSR1GRM5MGLL
SCHEMBL3815634 0.80 MAPK1 (0.34) MAPK1NPSR1PROKR1GRM5ALDH1A1

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