SCHEMBL3819977

SCHEMBL3819977

CCC1c2cccc(F)c2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F11 P03951 3/20 0.38
KLKB1 P03952 3/20 0.38
NPSR1 Q6W5P4 2/20 0.34
RIPK1 Q13546 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
NPC1 O15118 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPK1 P28482 1/20 0.33
STAT3 P40763 1/20 0.33
LMNA P02545 1/20 0.33
DRD4 P21917 1/20 0.32
TP53 P04637 1/20 0.32
XIAP P98170 2/20 0.32
GAA P10253 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
SCHEMBL3810315 0.89 ALDH1A1 (0.35) F11KLKB1RIPK1KDM4EALDH1A1
SCHEMBL3816988 0.88 F11 (0.39) F11KLKB1NPSR1RIPK1MAPK1
SCHEMBL3815189 0.86 LMNA (0.36) NPSR1RIPK1ALDH1A1LMNAXIAP
SCHEMBL3813134 0.86 KLKB1 (0.39) F11KLKB1NPSR1KDM4EALDH1A1
SCHEMBL3811239 0.85 MEN1 (0.42) KDM4EALDH1A1NPC1TSHRHTT
SCHEMBL1008931 0.85 GRM5 (0.43) F11KLKB1NPSR1KDM4EALDH1A1
SCHEMBL3810869 0.84 MTNR1B (0.43)
SCHEMBL3815399 0.83 OPRK1 (0.42) KDM4EHTR2AHTR2CNPC1RAB9A
SCHEMBL3821100 0.80 HHAT (0.41) NPSR1MAPK1
SCHEMBL3812048 0.80 P2RX7 (0.36) NPSR1RIPK1

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