SCHEMBL3816652

SCHEMBL3816652

Cc1ccc2n1CCN(C(=O)c1cc3ccc(Br)cn3n1)C2C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.51
GAA P10253 6/20 0.51
MAPT P10636 5/20 0.51
KMT2A Q03164 5/20 0.51
KDM4E B2RXH2 4/20 0.51
MEN1 O00255 4/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TSHR P16473 2/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SHMT2 P34897 3/20 0.32
ALOX15 P16050 2/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TP53 P04637 1/20 0.32
ESR2 Q92731 2/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL3811828 0.91 ALDH1A1 (0.39) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL3821005 0.89 ALDH1A1 (0.38) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL3815328 0.88 MAPT (0.51) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL3814878 0.86 GAA (0.36) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL3818908 0.85 ALDH1A1 (0.35) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL3821033 0.85 MAPT (0.35) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL3813952 0.84 GAA (0.35) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL3813972 0.84 ALDH1A1 (0.36) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL928895 0.84 ALDH1A1 (0.53) ALDH1A1GAAMAPTKMT2AKDM4E
SCHEMBL928294 0.84 ALDH1A1 (0.53) ALDH1A1GAAMAPTKMT2AKDM4E

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 5 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
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