SCHEMBL3816664

SCHEMBL3816664

CC1c2ccc(-c3ccsc3)n2CCN1C(=O)c1cc2ccc(Br)cn2n1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TP53 P04637 1/20 0.32
TACR3 P29371 2/20 0.32
PTGS2 P35354 1/20 0.31
GRM5 P41594 1/20 0.30

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
SCHEMBL3810166 0.89 TACR3 (0.34) GAAKDM4EMEN1ALDH1A1MAPT
SCHEMBL3813952 0.89 GAA (0.35) GAAKDM4EMEN1ALDH1A1MAPT
SCHEMBL3811860 0.86 GAA (0.34) GAAKDM4EMEN1ALDH1A1MAPT
SCHEMBL928748 0.86 ALDH1A1 (0.46) GAAALDH1A1MAPTKMT2AGRM5
SCHEMBL3811664 0.85 TACR3 (0.43) TACR3
SCHEMBL3817563 0.85 ALDH1A1 (0.33) GAAKDM4EMEN1ALDH1A1MAPT
SCHEMBL3815517 0.85 TACR3 (0.40) TACR3
SCHEMBL3810710 0.84 ALDH1A1 (0.33) GAAKDM4EMEN1ALDH1A1MAPT
SCHEMBL3811828 0.84 ALDH1A1 (0.39) GAAKDM4EMEN1ALDH1A1MAPT
SCHEMBL3816652 0.83 ALDH1A1 (0.51) GAAKDM4EMEN1ALDH1A1MAPT

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