SCHEMBL3820007

SCHEMBL3820007

CCCNC(=O)c1ccc2n1CCN(C(=O)c1cc3ccc(Br)cn3n1)C2C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
SMN1; SMN2 Q16637 6/20 0.34
MAPT P10636 5/20 0.34
RAB9A P51151 3/20 0.34
NPC1 O15118 2/20 0.34
NAMPT P43490 1/20 0.34
KDM4E B2RXH2 5/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
GAA P10253 2/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TP53 P04637 1/20 0.32
HSD17B10 Q99714 2/20 0.31
LMNA P02545 1/20 0.31
BRD4 O60885 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
SCHEMBL3820926 0.93 MAPT (0.34) SMN1; SMN2MAPTRAB9ANPC1KDM4E
SCHEMBL3819959 0.90 KDM4E (0.37) POLBTDP1SMN1; SMN2MAPTKDM4E
SCHEMBL3821033 0.88 MAPT (0.35) TDP1SMN1; SMN2MAPTRAB9ANPC1
SCHEMBL3816915 0.88 KDM4E (0.35) SMN1; SMN2MAPTRAB9ANPC1KDM4E
SCHEMBL929943 0.86 RECQL (0.48) POLBTDP1SMN1; SMN2MAPTRAB9A
SCHEMBL3820003 0.86 ALDH1A1 (0.34) TDP1SMN1; SMN2MAPTRAB9ANPC1
SCHEMBL3816172 0.82 KDM4E (0.35) SMN1; SMN2MAPTRAB9ANPC1KDM4E
SCHEMBL3811828 0.82 ALDH1A1 (0.39) POLBTDP1SMN1; SMN2MAPTRAB9A
SCHEMBL3816652 0.81 ALDH1A1 (0.51) TDP1SMN1; SMN2MAPTRAB9ANPC1
SCHEMBL3817831 0.81 NAMPT (0.36) POLBTDP1SMN1; SMN2MAPTRAB9A

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