SCHEMBL3815980

SCHEMBL3815980

O=C(c1cc2c(Cl)cc(Cl)cn2n1)N1CCn2cnnc2C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.42
SPR P35270 1/20 0.39
P2RX7 Q99572 6/20 0.38
SYK P43405 1/20 0.37
SCN9A Q15858 1/20 0.37
DPP4 P27487 3/20 0.37
DPP8 Q6V1X1 2/20 0.37
GRM5 P41594 1/20 0.37
PARP1 P09874 1/20 0.36
PIK3CA P42336 2/20 0.35
MTOR P42345 2/20 0.35
CDK1 P06493 1/20 0.35
MYT1 Q01538 1/20 0.35
NOTUM Q6P988 1/20 0.35
MALT1 Q9UDY8 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
SCHEMBL3816976 0.87 NAMPT (0.39) NAMPTSPRP2RX7SYKSCN9A
SCHEMBL3812163 0.86 NAMPT (0.39) NAMPTSPRP2RX7SYKSCN9A
SCHEMBL3816866 0.83 NAMPT (0.44) NAMPTSPRP2RX7SYKSCN9A
SCHEMBL3820161 0.83 SCD (0.47) NAMPTSPRP2RX7GRM5PIK3CA
SCHEMBL929415 0.82 GRM5 (0.57) NAMPTSCN9AGRM5
SCHEMBL4473093 0.81 SCD (0.37) NAMPTSPRP2RX7SYKSCN9A
SCHEMBL3814192 0.80 NAMPT (0.42) NAMPTSPRP2RX7SCN9ADPP4
SCHEMBL3818796 0.76 SCN9A (0.40) NAMPTSPRSCN9ADPP4DPP8
SCHEMBL3811238 0.76 NAMPT (0.39) NAMPTSPRSCN9ADPP4DPP8
SCHEMBL3815966 0.74 SPR (0.56) SPR

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