SCHEMBL4154137

SCHEMBL4154137

Cn1c(CN2CCN(c3cccc(Cl)c3)CC2)nc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 1.00
OPRM1 P35372 1/20 1.00
OPRD1 P41143 1/20 1.00
GRM2 Q14416 12/20 0.77
DRD4 P21917 10/20 0.77
LMNA P02545 3/20 0.77
SMN1; SMN2 Q16637 2/20 0.77
POLB P06746 1/20 0.77
GAA P10253 1/20 0.77
MAPK1 P28482 1/20 0.77
DRD2 P14416 3/20 0.66
DRD3 P35462 3/20 0.66
MAPT P10636 2/20 0.64
GFER P55789 1/20 0.64
HTT P42858 1/20 0.57
USP2 O75604 1/20 0.55
TSHR P16473 1/20 0.55

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
SCHEMBL4138550 0.87 GRM2 (0.77) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL4139747 0.87 GRM2 (1.00) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL4138559 0.86 GRM2 (1.00) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL4144234 0.86 GRM2 (0.77) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL31267403 0.84 KDM4E (0.72) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL5156990 0.82 GRM2 (0.81) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL4147946 0.81 GRM2 (0.83) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL4143642 0.81 GRM2 (0.76) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL4151775 0.80 GRM2 (0.81) KDM4EOPRM1OPRD1GRM2DRD4
SCHEMBL4144179 0.79 GRM2 (0.75) KDM4EOPRM1OPRD1GRM2DRD4

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 7 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
EP-2004613-A2 BICYCLIC BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS AstraZeneca AB (SE) 2008-12-24 EP claimed
WO-2007115077-A2 BICYCLIC BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2007-10-11 WO 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 KDM4E 3143/4885OPRM1 141/4885OPRD1 106/4885

“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.