SCHEMBL3814960

SCHEMBL3814960

CC1c2scc(Br)c2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPC3 Q13507 3/20 0.34
TRPC6 Q9Y210 3/20 0.34
GRM5 P41594 5/20 0.32
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
P2RX7 Q99572 2/20 0.31
F11 P03951 1/20 0.31
KLKB1 P03952 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
TACR2 P21452 1/20 0.30

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
SCHEMBL3816445 0.91 P2RX7 (0.35) TRPC3TRPC6GRM5TP53MAPT
SCHEMBL3813268 0.90 GRM5 (0.35) TRPC3TRPC6GRM5TP53MAPT
SCHEMBL3820332 0.86 GRM5 (0.33) TRPC3TRPC6GRM5TP53MAPT
SCHEMBL3813529 0.84 F11 (0.40) TRPC3TRPC6GRM5TP53MAPT
SCHEMBL1870139 0.84 GRM5 (0.49) GRM5MAPTALDH1A1TSHR
SCHEMBL3813363 0.83 TRPC3 (0.34) TRPC3TRPC6GRM5TP53MAPT
SCHEMBL3815233 0.82 ALDH1A1 (0.32) TRPC3TRPC6GRM5TP53MAPT
SCHEMBL3812712 0.81 KMT2A (0.41) MAPTMAPK1NPSR1ALDH1A1KDM4E
SCHEMBL3816863 0.80 TRPC3 (0.35) TRPC3TRPC6GRM5TP53MAPT
SCHEMBL3812051 0.80 DRD1 (0.47) GRM5MAPK1NPSR1

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