SCHEMBL3813017

SCHEMBL3813017

CC1c2ccc(-c3nn[nH]n3)cc2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.39
AKR1C4 P17516 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KLKB1 P03952 1/20 0.35
RPA1 P27694 1/20 0.34
IDO1 P14902 1/20 0.34
DRD1 P21728 1/20 0.34
PARP1 P09874 1/20 0.34
XDH P47989 1/20 0.34
GPR183 P32249 2/20 0.34
HRH1 P35367 1/20 0.34
CCR3 P51677 1/20 0.34
DPP4 P27487 1/20 0.34
HTT P42858 1/20 0.33
NCOA1 Q15788 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NCOA3 Q9Y6Q9 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
SCHEMBL3822282 0.94 MEN1 (0.38) AKR1C3AKR1C4MEN1KMT2AKLKB1
SCHEMBL3816438 0.90 AKR1C3 (0.39) AKR1C3AKR1C4MEN1KMT2AXDH
SCHEMBL1013466 0.87 GRM5 (0.41) AKR1C3AKR1C4MEN1KMT2AKLKB1
SCHEMBL3818898 0.85 PARP1 (0.38) AKR1C3AKR1C4MEN1KMT2AKLKB1
SCHEMBL3817979 0.85 AKR1C3 (0.38) AKR1C3AKR1C4MEN1KMT2APARP1
SCHEMBL3821199 0.83 QRFPR (0.38) MEN1KMT2ADRD1
SCHEMBL3817657 0.83 MCHR1 (0.40) MEN1KMT2ADRD1
SCHEMBL3813694 0.82 KMT2A (0.35) MEN1KMT2ADRD1PARP1HTT
SCHEMBL3815213 0.82 MEN1 (0.36) MEN1KMT2AKLKB1DRD1HTT
SCHEMBL3811512 0.81 DRD1 (0.35) MEN1KMT2ADRD1PARP1HTT

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