SCHEMBL3815643

SCHEMBL3815643

Cc1cccc2c1CCN(C(=O)c1cc3ccc(Cl)cn3n1)C2C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
TP53 P04637 1/20 0.38
DRD1 P21728 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.36
LMNA P02545 1/20 0.36
GRM5 P41594 7/20 0.35
STAT3 P40763 1/20 0.35
PROKR1 Q8TCW9 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
P2RX7 Q99572 1/20 0.33
TRPC3 Q13507 1/20 0.33
TRPC6 Q9Y210 1/20 0.33

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
SCHEMBL3816988 0.91 F11 (0.39) DRD1MAPK1NPSR1GRM5STAT3
SCHEMBL3820067 0.91 DRD1 (0.42) MAPTTP53DRD1MAPK1NPSR1
SCHEMBL3813529 0.90 F11 (0.40) MAPTTP53DRD1MAPK1NPSR1
SCHEMBL3818785 0.88 DRD1 (0.36) MAPTTP53DRD1MAPK1NPSR1
SCHEMBL3817104 0.88 ALDH1A1 (0.36) MAPTMAPK1NPSR1NPC1RAB9A
SCHEMBL3819222 0.87 F11 (0.40) MAPTTP53DRD1MAPK1NPSR1
SCHEMBL4464614 0.87 ALDH1A1 (0.34) MAPTTP53DRD1MAPK1NPSR1
SCHEMBL3811819 0.87 DRD1 (0.35) MAPTTP53DRD1MAPK1NPSR1
SCHEMBL3816923 0.87 P2RX7 (0.41) P2RX7
SCHEMBL3815561 0.86 F11 (0.38) MAPTDRD1MAPK1NPSR1ALDH1A1

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