SCHEMBL3819331

SCHEMBL3819331

CC1c2ccc(-c3ccccn3)n2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 6/20 0.42
TACR3 P29371 7/20 0.40
ALDH1A1 P00352 2/20 0.38
GRM5 P41594 2/20 0.35
ADORA2A P29274 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MGLL Q99685 1/20 0.33

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
SCHEMBL3813543 0.90 TACR3 (0.40) P2RX7TACR3ALDH1A1GRM5ADORA2A
SCHEMBL3819284 0.89 P2RX7 (0.37) P2RX7TACR3ALDH1A1GRM5KDM4E
SCHEMBL927706 0.87 P2RX7 (0.42) P2RX7TACR3ALDH1A1GRM5KDM4E
SCHEMBL3819291 0.85 P2RX7 (0.60) P2RX7TACR3
SCHEMBL3819602 0.85 MAPT (0.35) TACR3ALDH1A1GRM5KDM4EMEN1
SCHEMBL3816945 0.83 GRM5 (0.34) TACR3ALDH1A1GRM5KDM4EMEN1
SCHEMBL3816870 0.83 KDM4E (0.39) TACR3ALDH1A1KDM4EMEN1GAA
SCHEMBL3820990 0.82 TACR3 (0.37) TACR3ALDH1A1ADORA2AKDM4EMEN1
SCHEMBL3819940 0.82 TACR3 (0.40) TACR3
SCHEMBL3815328 0.82 MAPT (0.51) TACR3ALDH1A1KDM4EMEN1GAA

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