SCHEMBL3810487

SCHEMBL3810487

O=C(O)c1cc2c([N+](=O)[O-])cc(Cl)cn2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.37
ALKBH5 Q6P6C2 2/20 0.36
FTO Q9C0B1 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
RPA1 P27694 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIA1 P42261 1/20 0.34
GRIA2 P42262 1/20 0.34
GRIA3 P42263 1/20 0.34
GRIA4 P48058 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
FLT1 P17948 1/20 0.34

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
SCHEMBL3820671 0.84 ALDH1A1 (0.34) L3MBTL1SMN1; SMN2MEN1KMT2A
SCHEMBL3817857 0.83 CASP6 (0.37) CASP6L3MBTL1APOBEC3AAPOBEC3GFBP1
SCHEMBL3817231 0.79 RPA1 (0.41) L3MBTL1APOBEC3AAPOBEC3GRPA1SMN1; SMN2
SCHEMBL3818567 0.77 APOBEC3A (0.50) L3MBTL1APOBEC3AAPOBEC3GSMN1; SMN2MEN1
SCHEMBL3820978 0.77 KMT2A (0.35) ALKBH5SMN1; SMN2MEN1KMT2A
SCHEMBL13720160 0.75 CYP1A2 (0.39) L3MBTL1SMN1; SMN2
SCHEMBL3813373 0.75 GAA (0.60) MEN1KMT2A
SCHEMBL3818952 0.73 SCD (0.43) SMN1; SMN2
SCHEMBL3810745 0.72 MARS1 (0.38) L3MBTL1APOBEC3AAPOBEC3GRPA1SMN1; SMN2
SCHEMBL3815336 0.72 GAA (0.44) SMN1; SMN2

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