SCHEMBL16887883

SCHEMBL16887883

Cc1ccc(O)c(C(CC[N+](C)(C(C)C)C(C)C)c2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.62
CHRM1 P11229 4/20 0.62
MAPT P10636 4/20 0.62
CHRM2 P08172 3/20 0.62
CHRM3 P20309 3/20 0.62
CHRM5 P08912 2/20 0.62
HRH1 P35367 2/20 0.62
KCNH2 Q12809 2/20 0.62
ADRA1A P35348 2/20 0.62
ESR1 P03372 1/20 0.62
CHRM4 P08173 1/20 0.62
KCNE1 P15382 1/20 0.62
PTGS1 P23219 1/20 0.62
HRH2 P25021 1/20 0.62
HTR2A P28223 1/20 0.62
SLC6A4 P31645 1/20 0.62
OPRK1 P41145 1/20 0.62
KCNQ1 P51787 1/20 0.62
CACNA1C Q13936 1/20 0.62
SCN5A Q14524 1/20 0.62

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
SCHEMBL4661373 1.00 LMNA (0.62) LMNACHRM1MAPTCHRM2CHRM3
Hydrochloric Acid SCHEMBL4660997 0.99 LMNA (0.61) LMNACHRM1MAPTCHRM2CHRM3
Iodide SCHEMBL4661249 0.99 LMNA (0.61) LMNACHRM1MAPTCHRM2CHRM3
Bromide SCHEMBL4662300 0.99 LMNA (0.61) LMNACHRM1MAPTCHRM2CHRM3
SCHEMBL4662570 0.90 CHRM1 (0.48) LMNACHRM1MAPTCHRM2CHRM3
Tolterodine SCHEMBL6052412 0.90 CHRM3 (0.78) LMNACHRM1MAPTCHRM2CHRM3
SCHEMBL4662609 0.89 CHRM1 (0.49) LMNACHRM1MAPTCHRM2CHRM3
Iodide SCHEMBL4662550 0.89 CHRM1 (0.47) LMNACHRM1MAPTCHRM2CHRM3
SCHEMBL4663900 0.88 CHRM1 (0.49) LMNACHRM1MAPTCHRM2CHRM3
Iodide SCHEMBL4661363 0.88 CHRM1 (0.48) LMNACHRM1MAPTCHRM2CHRM3

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-20150191430-A1 CONJUGATES OF HUPERZINE AND ANALOGS THEREOF BISCAYNE NEUROTHERAPEUTICS, INC. 2015-07-09 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-20150191430-A1 CONJUGATES OF HUPERZINE AND ANALOGS THEREOF HTT, HNMT, GAP43 LMNA 748/4885CHRM1 1559/4885MAPT 5/4885

“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.