SCHEMBL3820127

SCHEMBL3820127

COc1cc(Cl)cn2nc(C(=O)N3CCc4ccccc4[C@H]3C)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
DRD1 P21728 1/20 0.45
GRM5 P41594 3/20 0.44
ALDH1A1 P00352 3/20 0.43
HTT P42858 3/20 0.43
GAA P10253 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TSHR P16473 1/20 0.43
RAB9A P51151 1/20 0.43
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
KDM4E B2RXH2 2/20 0.42
TRPC3 Q13507 1/20 0.42
TRPC6 Q9Y210 1/20 0.42
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
RIPK1 Q13546 1/20 0.41
NCOA1 Q15788 1/20 0.41

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
SCHEMBL3816874 1.00 KMT2A (0.47) KMT2AMEN1DRD1GRM5ALDH1A1
SCHEMBL3821054 0.89 HTT (0.45) KMT2AMEN1GRM5ALDH1A1HTT
SCHEMBL3812898 0.89 HTT (0.45) KMT2AMEN1GRM5ALDH1A1HTT
SCHEMBL3818709 0.88 DRD1 (0.51) KMT2AMEN1DRD1GRM5ALDH1A1
SCHEMBL3820422 0.88 DRD1 (0.51) KMT2AMEN1DRD1GRM5ALDH1A1
SCHEMBL3813802 0.88 KMT2A (0.47) KMT2AMEN1ALDH1A1HTTGAA
SCHEMBL3812443 0.85 HPGD (0.52) KMT2AMEN1ALDH1A1HTTGAA
SCHEMBL3819266 0.85 KMT2A (0.44) KMT2AMEN1DRD1GRM5ALDH1A1
SCHEMBL3820563 0.85 KMT2A (0.41) KMT2AMEN1ALDH1A1HTTGAA
SCHEMBL3816553 0.83 GAA (0.44) DRD1GRM5ALDH1A1HTTGAA

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