SCHEMBL3811906

SCHEMBL3811906

Cc1noc(C)c1-c1ccc2c(c1)C(C)N(C(=O)c1cc3ccc(Br)cn3n1)CC2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.41
UCHL1 P09936 1/20 0.38
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
DRD3 P35462 1/20 0.37
HTR6 P50406 1/20 0.37
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
GHSR Q92847 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL3817108 0.93 UCHL1 (0.40) BRD4UCHL1TP53GAADRD2
SCHEMBL3815242 0.91 BRD4 (0.42) BRD4UCHL1DRD2HTR2AHTR2C
SCHEMBL4181173 0.87 BRD4 (0.33) BRD4UCHL1
SCHEMBL1011028 0.87 GRM5 (0.46) BRD4GAATSHR
SCHEMBL3817877 0.85 UCHL1 (0.40) BRD4UCHL1DRD2HTR2AHTR2C
SCHEMBL3817616 0.84 HTT (0.40) GAALMNAMAPK1HTTTSHR
SCHEMBL3819788 0.83 MAPK1 (0.37) TP53GAALMNAMAPK1HTT
SCHEMBL3810902 0.83 KMT2A (0.41) GAALMNAMAPK1HTTTSHR
SCHEMBL3818004 0.83 UCHL1 (0.39) BRD4UCHL1TP53GAATHRB
SCHEMBL3815307 0.83 LMNA (0.36) TP53GAALMNAMAPK1HTT

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