SCHEMBL7520899

SCHEMBL7520899

Brc1cncc(OCC2CCN(Cc3ccccc3)C2)c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
ACHE P22303 4/20 0.47
GSK3B P49841 2/20 0.47
MAOA P21397 2/20 0.47
MAOB P27338 2/20 0.47
DRD2 P14416 3/20 0.46
DRD4 P21917 3/20 0.46
DRD3 P35462 2/20 0.46

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
SCHEMBL7520395 0.86 CHRNB2 (0.55) CHRNB2CHRNA4ACHEGSK3BMAOA
SCHEMBL7521464 0.86 ACHE (0.52) CHRNB2CHRNA4ACHEGSK3BMAOA
SCHEMBL7516953 0.83 DRD4 (0.48) ACHEDRD2DRD4DRD3
SCHEMBL7464246 0.81 ROCK1 (0.54) ACHEGSK3BMAOAMAOB
SCHEMBL7464417 0.81 ROCK1 (0.54) ACHEGSK3BMAOAMAOB
SCHEMBL29960864 0.79 ACHE (0.53) ACHEGSK3BMAOAMAOB
SCHEMBL28512442 0.79 ACHE (0.53) ACHEGSK3BMAOAMAOB
SCHEMBL19959133 0.78 CHRNB2 (0.62) CHRNB2CHRNA4
SCHEMBL28514129 0.77 ACHE (0.51) ACHEGSK3BMAOAMAOB
SCHEMBL29318739 0.77 CHRNB2 (0.57) CHRNB2CHRNA4

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-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission LIN NAN-HORNG (US) 2002-10-17 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-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission GAP43, SLC18A2, GABRE CHRNB2 16/4885CHRNA4 12/4885ACHE 126/4885

“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.