SCHEMBL3811283

SCHEMBL3811283

CC1c2ccc(-c3ccoc3)cc2CCN1C(=O)c1cc2ccc(Br)cn2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.36
MAPK1 P28482 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
NPSR1 Q6W5P4 2/20 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
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC2 Q92769 1/20 0.33
TRPC3 Q13507 1/20 0.32
TRPC6 Q9Y210 1/20 0.32
ABCB1 P08183 1/20 0.32
ABCG2 Q9UNQ0 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
SCHEMBL3820420 0.93 MAPK1 (0.36) HTTMAPK1LMNAGAAMEN1
SCHEMBL3811512 0.90 DRD1 (0.35) HTTMAPK1LMNAGAAMEN1
SCHEMBL3815394 0.86 HTT (0.36) HTTMAPK1LMNAGAAMEN1
SCHEMBL1010085 0.86 GRM5 (0.47) GAAKMT2AALDH1A1MAPTGRM5
SCHEMBL3815429 0.86 HTT (0.40) HTTMAPK1LMNAMEN1KMT2A
SCHEMBL3818631 0.86 HTT (0.35) HTTMAPK1LMNAGAAMEN1
SCHEMBL3813548 0.85 GRM5 (0.33) HTTMAPK1LMNAGAAMEN1
SCHEMBL3811192 0.85 ALDH1A1 (0.42) HTTMAPK1LMNAGAAMEN1
SCHEMBL3819778 0.85 GSK3B (0.35) HTTMAPK1LMNAGRM5
SCHEMBL3815436 0.84 ALDH1A1 (0.32) HTTMAPK1LMNAGAAALDH1A1

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