SCHEMBL4138550

SCHEMBL4138550

Cc1cccc(N2CCN(Cc3nc4ccccc4n3C)CC2)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 12/20 0.77
KDM4E B2RXH2 2/20 0.77
OPRM1 P35372 1/20 0.77
OPRD1 P41143 1/20 0.77
DRD4 P21917 9/20 0.67
LMNA P02545 4/20 0.67
GAA P10253 3/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
POLB P06746 1/20 0.67
MAPK1 P28482 1/20 0.67
MAPT P10636 2/20 0.65
GFER P55789 1/20 0.65
ALDH1A1 P00352 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
DRD2 P14416 2/20 0.54
DRD3 P35462 2/20 0.54
KCNH2 Q12809 2/20 0.53
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53

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
SCHEMBL4138559 0.87 GRM2 (1.00) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL4154137 0.87 KDM4E (1.00) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL4147946 0.86 GRM2 (0.83) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL5156990 0.83 GRM2 (0.81) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL31267403 0.82 KDM4E (0.72) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL4144234 0.82 GRM2 (0.77) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL4139747 0.81 GRM2 (1.00) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL4151775 0.81 GRM2 (0.81) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL24985245 0.81 GRM2 (0.64) GRM2KDM4EOPRM1OPRD1DRD4
SCHEMBL15467817 0.81 GRM2 (0.72) GRM2KDM4EOPRM1OPRD1DRD4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US claimed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US disclosed
WO-2007115077-A2 BICYCLIC BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2007-10-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators GRM1, GRIN1, GRM2 GRM2 3/4885KDM4E 3143/4885OPRM1 141/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.