SCHEMBL7528587

SCHEMBL7528587

CN1CCCC1COc1cnc(Cl)c(Br)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 4/20 0.66
CHRNA3 P32297 4/20 0.66
CHRNA7 P36544 1/20 0.66
CHRNB2 P17787 5/20 0.65
CHRNA4 P43681 5/20 0.65
CHRNB1 P11230 2/20 0.63
CHRNB3 Q05901 2/20 0.63

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
SCHEMBL6582880 1.00 CHRNB4 (0.66) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
SCHEMBL6585296 1.00 CHRNB4 (0.66) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL6591049 0.99 CHRNB4 (0.65) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL6594795 0.99 CHRNB4 (0.65) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
SCHEMBL7816212 0.92 CHRNA3 (0.61) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
SCHEMBL7410204 0.92 CHRNA3 (0.61) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL7816957 0.91 CHRNA3 (0.60) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL7418741 0.91 CHRNA3 (0.60) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
SCHEMBL7817031 0.87 CHRNB4 (0.72) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4
SCHEMBL7826052 0.87 CHRNB4 (0.72) CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4

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 CHRNB4 11/4885CHRNA3 10/4885CHRNA7 28/4885

“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.