SCHEMBL3810604

SCHEMBL3810604

Cc1n[nH]cc1-c1ccc2c(c1)C(C)N(C(=O)c1cc3ccc(Cl)cn3n1)CC2

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
PARP1 P09874 3/20 0.33
MAPK1 P28482 2/20 0.33
HTT P42858 2/20 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
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
SPR P35270 3/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL3813694 0.94 KMT2A (0.35) KMT2AMEN1PARP1MAPK1HTT
SCHEMBL3811690 0.91 MAPK1 (0.35) KMT2AMEN1PARP1MAPK1HTT
SCHEMBL1011395 0.87 GRM5 (0.42) KMT2AMEN1GAAMAPTKDM4E
SCHEMBL3810606 0.85 PARP1 (0.36) KMT2AMEN1PARP1SPR
SCHEMBL3817306 0.84 MEN1 (0.37) KMT2AMEN1MAPK1HTTGAA
SCHEMBL4557563 0.84 DRD1 (0.31) PARP1SPR
SCHEMBL3820726 0.84 HTT (0.35) KMT2AMEN1MAPK1HTTGAA
SCHEMBL3812986 0.84 MAPK1 (0.34) PARP1MAPK1MAPTSPR
SCHEMBL3816607 0.83 KMT2A (0.42) KMT2AMEN1PARP1MAPK1HTT
SCHEMBL3810668 0.83 KMT2A (0.41) KMT2AMEN1MAPK1HTTGAA

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