SCHEMBL29299504

SCHEMBL29299504

CC(=O)CN1CCNCCN(CC(=O)O)CCN(CC(=O)O)CC1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.47
CHRM3 P20309 2/20 0.47
SIGMAR1 Q99720 6/20 0.44
HSD17B10 Q99714 1/20 0.42
SLC6A9 P48067 1/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
S1PR1 P21453 1/20 0.34

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
SCHEMBL13525120 1.00 CHRM5 (0.47) CHRM5CHRM3SIGMAR1HSD17B10SLC6A9
SCHEMBL27404930 1.00 CHRM5 (0.47) CHRM5CHRM3SIGMAR1HSD17B10SLC6A9
SCHEMBL29299503 0.98 CHRM5 (0.49) CHRM5CHRM3SIGMAR1HSD17B10KMT2A
Acetic Acid SCHEMBL26964860 0.92 CHRM5 (0.50) CHRM5CHRM3SIGMAR1HSD17B10SLC6A9
SCHEMBL13742551 0.92 CHRM5 (0.53) CHRM5CHRM3SIGMAR1KMT2AMEN1
SCHEMBL16800789 0.91 SIGMAR1 (0.48) CHRM5CHRM3SIGMAR1HSD17B10KMT2A
SCHEMBL24247411 0.90 CHRM5 (0.55) CHRM5CHRM3SIGMAR1HSD17B10KMT2A
SCHEMBL8038 0.90 CHRM5 (0.55) CHRM5CHRM3SIGMAR1HSD17B10KMT2A
SCHEMBL29299554 0.90 CHRM5 (0.50) CHRM5CHRM3SIGMAR1HSD17B10SLC6A9
SCHEMBL472213 0.90 CHRM5 (0.50) CHRM5CHRM3SIGMAR1HSD17B10SLC6A9

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-20240226343-A1 NEUROPEPTIDE Y1 RECEPTOR (NPY1R) TARGETED THERAPEUTICS AND USES THEREOF RADIONETICS ONCOLOGY, INC. 2024-07-11 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-20240226343-A1 NEUROPEPTIDE Y1 RECEPTOR (NPY1R) TARGETED THERAPEUTICS AND USES THEREOF NPY1R, NPY2R, NPY4R CHRM5 2123/4885CHRM3 1728/4885SIGMAR1 231/4885

“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.