SCHEMBL3813178

SCHEMBL3813178

Cc1ccc2c(c1)N(C)N(C(=O)c1cc3ccc(Cl)cn3n1)CC2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
DRD2 P14416 2/20 0.39
DRD4 P21917 2/20 0.39
HRH4 Q9H3N8 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
NOTUM Q6P988 3/20 0.36
GRM5 P41594 3/20 0.34
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
HSD17B3 P37058 1/20 0.32
HDAC1 Q13547 1/20 0.31

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
SCHEMBL3810974 0.93 NOTUM (0.43) ALDH1A1LMNATSHRDRD2DRD4
SCHEMBL3812865 0.92 NOTUM (0.39) ALDH1A1LMNATSHRDRD2DRD4
SCHEMBL3819391 0.89 DRD2 (0.38) ALDH1A1DRD2DRD4HRH4HRH3
SCHEMBL3820261 0.89 GRM5 (0.39) ALDH1A1LMNAHRH4HRH3NOTUM
SCHEMBL3820015 0.88 ALDH1A1 (0.40) ALDH1A1LMNATSHRGRM5MAPT
SCHEMBL3813190 0.88 SMN1; SMN2 (0.39) ALDH1A1LMNATSHRSMN1; SMN2RAB9A
SCHEMBL3816462 0.87 MAPT (0.36) LMNADRD2NOTUMGRM5MAPT
SCHEMBL3816431 0.86 NOTUM (0.43) HRH4HRH3NOTUMGRM5MAPT
SCHEMBL3812252 0.86 XIAP (0.35) ALDH1A1LMNATSHRDRD2HRH4
SCHEMBL3817696 0.86 CNR2 (0.38) ALDH1A1LMNATSHRHRH4HRH3

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