SCHEMBL4931423

SCHEMBL4931423

Cn1c(CN2CCC(O)CC2)nc2ccccc21

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 14/20 0.72
DRD2 P14416 9/20 0.72
DRD4 P21917 8/20 0.72
DRD3 P35462 6/20 0.72
LMNA P02545 1/20 0.58
POLB P06746 1/20 0.58
GAA P10253 1/20 0.58
MAPK1 P28482 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58

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
SCHEMBL5156990 0.87 GRM2 (0.81) GRM2DRD2DRD4DRD3LMNA
SCHEMBL14374007 0.84 GRM2 (0.72) GRM2DRD2DRD4DRD3LMNA
SCHEMBL4147514 0.84 GRM2 (1.00) GRM2DRD2DRD4DRD3
SCHEMBL4139937 0.82 GRM2 (0.70) GRM2DRD2DRD4DRD3LMNA
SCHEMBL12629355 0.82 GRM2 (0.67) GRM2DRD2DRD4DRD3LMNA
SCHEMBL14197759 0.82 GRM2 (0.67) GRM2DRD2DRD4DRD3LMNA
SCHEMBL4146825 0.82 GRM2 (0.70) GRM2DRD2DRD4DRD3LMNA
SCHEMBL4144202 0.81 GRM2 (0.65) GRM2DRD2DRD4DRD3LMNA
SCHEMBL15730124 0.80 GRM2 (0.71) GRM2DRD2DRD4DRD3LMNA
SCHEMBL6585574 0.80 GRM2 (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280933-A1 BENZIMIDAZOLYL COMPOUNDS EFREMOV IVAN 2008-11-13 US 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-20080280933-A1 BENZIMIDAZOLYL COMPOUNDS PAICS, TMBIM6, ABCG2 GRM2 4477/4885DRD2 2308/4885DRD4 1204/4885

“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.