SCHEMBL7520395

SCHEMBL7520395

c1ccc(CN2CCC(COc3cncc(-c4ccccc4)c3)C2)cc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.55
CHRNB1 P11230 1/20 0.55
CHRNB4 P30926 1/20 0.55
CHRNA3 P32297 1/20 0.55
CHRNB3 Q05901 1/20 0.55
CHRNA4 P43681 1/20 0.54
ACHE P22303 6/20 0.50
MAOA P21397 4/20 0.49
MAOB P27338 4/20 0.49
GSK3B P49841 2/20 0.47

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
SCHEMBL7521464 0.86 ACHE (0.52) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL7520899 0.86 CHRNB2 (0.47) CHRNB2CHRNA4ACHEMAOAMAOB
SCHEMBL7461754 0.81 ROCK1 (0.54) CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3
SCHEMBL28512442 0.79 ACHE (0.53) ACHEMAOAMAOBGSK3B
SCHEMBL29960864 0.79 ACHE (0.53) ACHEMAOAMAOBGSK3B
SCHEMBL7516953 0.79 DRD4 (0.48) ACHE
SCHEMBL13450808 0.78 ACHE (0.54) ACHEMAOAMAOB
SCHEMBL28514129 0.77 ACHE (0.51) ACHEMAOAMAOBGSK3B
SCHEMBL15284997 0.77 DRD4 (0.70)
SCHEMBL15285000 0.77 DRD4 (0.70)

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 16/4885CHRNB1 97/4885CHRNB4 11/4885

“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.