SCHEMBL3810568

SCHEMBL3810568

COc1ncccc1-c1ccc2c(c1)CCN(C(=O)c1cc3ccc(Cl)cn3n1)C2C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 2/20 0.37
F11 P03951 1/20 0.37
KLKB1 P03952 1/20 0.37
GPR84 Q9NQS5 2/20 0.36
GRM5 P41594 1/20 0.36
MCHR1 Q99705 1/20 0.35
HTT P42858 2/20 0.35
NCOA1 Q15788 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
FPR1 P21462 1/20 0.35
FPR2 P25090 1/20 0.35
GRIN2C Q14957 1/20 0.34
KDM1A O60341 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
DRD1 P21728 1/20 0.34
GAA P10253 2/20 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
SCHEMBL3810414 0.94 KMT2A (0.38) MEN1KMT2AKDM4EF11KLKB1
SCHEMBL3820363 0.91 KDM4E (0.37) MEN1KMT2AKDM4EGPR84GRM5
SCHEMBL3810605 0.89 GRM5 (0.40) MEN1KMT2AGRM5MCHR1DRD1
SCHEMBL1009714 0.88 GRM5 (0.41) MEN1KMT2AKDM4EF11KLKB1
SCHEMBL3811199 0.88 KLKB1 (0.45) MEN1KMT2AKDM4EF11KLKB1
SCHEMBL13720168 0.87 MCHR1 (0.36) MEN1KMT2AGRM5MCHR1DRD1
SCHEMBL3816795 0.87 KMT2A (0.40) MEN1KMT2AKDM4EGPR84GRM5
SCHEMBL3812015 0.87 PPARD (0.41) MEN1KMT2AKDM4EHTTGAA
SCHEMBL3812746 0.84 GRM5 (0.42) GRM5DRD1ALDH1A1
SCHEMBL3817657 0.84 MCHR1 (0.40) MEN1KMT2AKDM4EGRM5MCHR1

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