SCHEMBL4728476

SCHEMBL4728476

COc1ccccc1C1CCC(=O)N(Cc2nc3ccccc3n2C)CC1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.73
DRD2 P14416 9/20 0.73
DRD3 P35462 6/20 0.53
DRD4 P21917 7/20 0.48
RAB9A P51151 2/20 0.47
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
GFER P55789 1/20 0.43
KCNH2 Q12809 1/20 0.42

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
SCHEMBL4933613 0.74 KCNH2 (0.61) GRM2DRD2DRD3DRD4RAB9A
SCHEMBL4725109 0.73 GRM2 (0.77) GRM2DRD2DRD3DRD4MEN1
SCHEMBL4726289 0.72 GRM2 (0.72) GRM2DRD2DRD3DRD4MEN1
SCHEMBL4925251 0.72 GRM2 (0.71) GRM2DRD2DRD3DRD4MEN1
SCHEMBL4725327 0.71 GRM2 (0.73) GRM2DRD2DRD3DRD4
Hydrochloric Acid SCHEMBL4777820 0.70 GRM2 (0.72) GRM2DRD2DRD3DRD4
SCHEMBL4728467 0.70 DRD2 (0.72) GRM2DRD2DRD3DRD4MEN1
SCHEMBL746995 0.68 HCRTR1 (0.53) GRM2DRD2RAB9AMEN1KMT2A
SCHEMBL4152680 0.67 GRM2 (0.71) GRM2DRD2DRD4LMNAMAPT
SCHEMBL5290305 0.66 HTR2C (0.62) DRD2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280933-A1 BENZIMIDAZOLYL COMPOUNDS EFREMOV IVAN 2008-11-13 US disclosed
WO-2008012623-A1 BENZIMIDAZOLYL COMPOUNDS AS POTENTIATORS OF MGLUR2 SUBTYPE OF GLUTAMATE RECEPTOR PFIZER PRODUCTS INC. (US) 2008-01-31 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-20080280933-A1 BENZIMIDAZOLYL COMPOUNDS PAICS, TMBIM6, ABCG2 GRM2 4477/4885DRD2 2308/4885DRD3 2334/4885

“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.