SCHEMBL4991012

SCHEMBL4991012

Brc1ccc(-c2cnc(C3CN4CCC3CC4)[nH]2)s1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.35
HTR3A P46098 1/20 0.34
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
SSTR3 P32745 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL9912090 0.73 CDC7 (0.37) CHRNA7HTR3A
SCHEMBL15692802 0.71 SCN10A (0.36) CHRNA7SSTR3KCNH2
SCHEMBL5107232 0.69 KCNH2 (0.50) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL5113459 0.68 CHRNA7 (0.35) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL9977178 0.66 SCN10A (0.42) SSTR3KCNH2
SCHEMBL4989041 0.66 HTR3A (0.42) HTR3A
SCHEMBL4989050 0.66 HTR3A (0.42) HTR3A
SCHEMBL16580636 0.66 HPGDS (0.44) KCNH2
SCHEMBL9912036 0.66 HPGDS (0.44) KCNH2
SCHEMBL13731619 0.65 HTR3A (0.64) 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-20080188518-A1 5-Substituted Imidazoles ASTRA ZENECA AB (SE) 2008-08-07 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-20080188518-A1 5-Substituted Imidazoles GABRA5, GRIN2C, GABRE CHRNA7 71/4885HTR3A 572/4885CHRM2 237/4885

“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.