SCHEMBL7686026

SCHEMBL7686026

CC(=O)c1nnc(Oc2ccccc2C(=O)N[C@H]2CN3CCC2CC3)s1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 4/20 0.50
HTR3A P46098 1/20 0.49
KCNH2 Q12809 1/20 0.49

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
SCHEMBL7699687 0.86 CHRNA7 (0.50) CHRNA7HTR3AKCNH2
SCHEMBL7047117 0.82 CHRNA7 (0.54) CHRNA7HTR3A
SCHEMBL7118206 0.81 CHRNA7 (0.53) CHRNA7HTR3A
SCHEMBL7708591 0.80 CHRNA7 (0.51) CHRNA7HTR3AKCNH2
SCHEMBL2230468 0.79 CHRNA7 (0.54) CHRNA7
SCHEMBL2230461 0.79 CHRNA7 (0.54) CHRNA7
SCHEMBL2228215 0.79 CHRNA7 (0.64) CHRNA7HTR3AKCNH2
SCHEMBL2228214 0.79 CHRNA7 (0.64) CHRNA7HTR3AKCNH2
SCHEMBL7281094 0.79 CHRNA7 (0.64) CHRNA7HTR3AKCNH2
SCHEMBL7156786 0.77 CHRNA7 (0.61) CHRNA7HTR3A

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-20020049225-A1 Quinuclidine-substituted aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2002-04-25 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-20020049225-A1 Quinuclidine-substituted aryl compounds for treatment of disease UGT1A1, NAT1, SLC10A1 CHRNA7 365/4885HTR3A 995/4885KCNH2 1201/4885

“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.