SCHEMBL3816613

SCHEMBL3816613

CC1c2cccc(-c3cncnc3)c2CCN1C(=O)c1cc2ccc(Br)cn2n1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 18/20 0.38
F11 P03951 11/20 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
SCHEMBL3811951 0.92 ADRA2A (0.35) KLKB1F11
SCHEMBL3818159 0.90 DRD2 (0.35) KLKB1F11
SCHEMBL3819025 0.89 DRD1 (0.40) KLKB1
SCHEMBL3815259 0.87 ALDH1A1 (0.37) KLKB1F11
SCHEMBL3818560 0.87 DRD1 (0.40) KLKB1
SCHEMBL1010418 0.87 GRM5 (0.47)
SCHEMBL3815436 0.86 ALDH1A1 (0.32) KLKB1F11
SCHEMBL3819045 0.86 GRM5 (0.36) KLKB1F11
SCHEMBL3813403 0.86 GRM5 (0.39) KLKB1F11
SCHEMBL3817104 0.84 ALDH1A1 (0.36)

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