SCHEMBL3813693

SCHEMBL3813693

O=C(c1cc2ccc(Br)cn2n1)N1CCc2ccc(-c3ccncc3)cc2C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR142 Q7Z601 2/20 0.46
GAA P10253 2/20 0.43
GRM5 P41594 5/20 0.41
HPGD P15428 2/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE4B Q07343 1/20 0.39
NAMPT P43490 1/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
POLB P06746 1/20 0.38
BCL2 P10415 1/20 0.38
BAD Q92934 1/20 0.38
PLA2G1B P04054 1/20 0.38

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
SCHEMBL3815199 0.97 GPR142 (0.43) GPR142GAAGRM5HPGDHTT
SCHEMBL3818172 0.88 ABHD6 (0.46) GAAGRM5HPGDHTTSMN1; SMN2
SCHEMBL4190577 0.87 GPR142 (0.37) GPR142GAAGRM5HPGDHTT
SCHEMBL3815812 0.85 GPR142 (0.47) GPR142GAAGRM5HPGDHTT
SCHEMBL1009853 0.85 GRM5 (0.60) GAAGRM5HPGDMAPTALDH1A1
SCHEMBL3816744 0.84 HPGD (0.54) GAAGRM5HPGDHTTSMN1; SMN2
SCHEMBL3812989 0.84 ABHD6 (0.46) GAAGRM5HPGDHTTSMN1; SMN2
SCHEMBL3815394 0.82 HTT (0.36) GPR142GAAGRM5HTTSMN1; SMN2
SCHEMBL3813666 0.82 NPSR1 (0.48) GAAGRM5HPGDHTTSMN1; SMN2
SCHEMBL3815307 0.82 LMNA (0.36) GPR142GAAGRM5HTTMEN1

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