SCHEMBL22482237

SCHEMBL22482237

CC/C=N/N1CCN(CC)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.32
HSD11B1 P28845 1/20 0.32
CHRNA7 P36544 1/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP2D6 P10635 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
GAA P10253 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
RAD52 P43351 1/20 0.31
GFER P55789 1/20 0.31

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
SCHEMBL22485142 0.79 CHRNA7 (0.33) SMN1; SMN2CHRNA7MAPK1L3MBTL1CYP2D6
Propane SCHEMBL28340961 0.76 MEN1 (0.31) MAPK1L3MBTL1KMT2A
SCHEMBL21428541 0.74 MAPK1 (0.31) SMN1; SMN2CHRNA7MAPK1L3MBTL1ALDH1A1
SCHEMBL24784481 0.73
SCHEMBL27522076 0.73
SCHEMBL577052 0.71 CHRNA7 (0.48) SMN1; SMN2HSD11B1CHRNA7CYP2D6ALDH1A1
SCHEMBL577415 0.71 CHRNA7 (0.48) SMN1; SMN2HSD11B1CHRNA7CYP2D6ALDH1A1
SCHEMBL84808 0.71 CHRNA7 (0.48) SMN1; SMN2HSD11B1CHRNA7CYP2D6ALDH1A1
SCHEMBL262312 0.71
SCHEMBL6657817 0.71 CHRNA7 (0.48) SMN1; SMN2HSD11B1CHRNA7CYP2D6ALDH1A1

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-20200308163-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2020-10-01 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-20200308163-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING TLR3, TLR6, TLR4 SMN1; SMN2 318/4885HSD11B1 4791/4885CHRNA7 2544/4885

“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.