SCHEMBL3815213

SCHEMBL3815213

CC1c2ccc(-c3cn[nH]c3)cc2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ROCK2 O75116 6/20 0.36
QRFPR Q96P65 1/20 0.35
DRD1 P21728 1/20 0.35
KLKB1 P03952 3/20 0.34
F11 P03951 1/20 0.34
GHSR Q92847 1/20 0.33
BRD4 O60885 1/20 0.33
BRD2 P25440 1/20 0.33
BRD3 Q15059 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MGLL Q99685 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
SCHEMBL3817306 0.94 MEN1 (0.37) MEN1KMT2AROCK2KLKB1F11
SCHEMBL3814145 0.90 ROCK2 (0.36) MEN1KMT2AROCK2GHSRGAA
SCHEMBL1011392 0.87 GRM5 (0.42) MEN1KMT2AROCK2QRFPRDRD1
SCHEMBL3821199 0.86 QRFPR (0.38) MEN1KMT2AQRFPRDRD1BRD4
SCHEMBL3817657 0.86 MCHR1 (0.40) MEN1KMT2AQRFPRDRD1
SCHEMBL3820312 0.86 ROCK2 (0.39) ROCK2DRD1MAPK1
SCHEMBL3820925 0.85 DRD1 (0.43) ROCK2DRD1KLKB1F11
SCHEMBL3813694 0.85 KMT2A (0.35) MEN1KMT2AQRFPRDRD1GAA
SCHEMBL3812450 0.84 QRFPR (0.37) MEN1KMT2AQRFPRDRD1
SCHEMBL3820349 0.84 ROCK2 (0.36) MEN1KMT2AROCK2GHSRGAA

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