SCHEMBL4154874

SCHEMBL4154874

Cc1ccc2c(c1)nc(CN1CCC(CCCc3ccccc3)CC1)n2C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 8/20 0.50
DRD2 P14416 6/20 0.50
DRD4 P21917 5/20 0.50
DRD3 P35462 5/20 0.50
ACHE P22303 3/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
BCHE P06276 2/20 0.45
P2RX3 P56373 2/20 0.44
MAOA P21397 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
RECQL P46063 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL4138733 0.92 GRM2 (0.50) GRM2DRD2DRD4DRD3ACHE
SCHEMBL4162244 0.89 GRM2 (0.53) GRM2DRD2DRD4DRD3LMNA
SCHEMBL13777211 0.88 GRM2 (0.64) GRM2DRD2DRD4DRD3LMNA
SCHEMBL8227474 0.87 GRM2 (0.54) GRM2DRD2DRD4DRD3ALDH1A1
SCHEMBL4149712 0.83 GRM2 (0.53) GRM2DRD2DRD4DRD3LMNA
SCHEMBL4141165 0.81 GRM2 (0.76) GRM2DRD2DRD4DRD3RECQL
SCHEMBL4152111 0.80 GRM2 (0.58) GRM2DRD2DRD4DRD3
SCHEMBL4151843 0.80 DRD2 (0.46) GRM2DRD2DRD4DRD3ACHE
SCHEMBL4142354 0.79 LMNA (0.61) GRM2DRD2DRD4DRD3LMNA
SCHEMBL4155805 0.79 DRD2 (0.54) GRM2DRD2DRD4DRD3LMNA

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 3/4885DRD2 101/4885DRD4 205/4885

“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.