SCHEMBL29299554

SCHEMBL29299554

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

nearest known ligand 0.95

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.50
CHRM3 P20309 2/20 0.50
HSD17B10 Q99714 1/20 0.50
SIGMAR1 Q99720 6/20 0.46
SLC6A9 P48067 1/20 0.40
CA2 P00918 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
CHKA P35790 1/20 0.37
KDM5C P41229 1/20 0.37
KDM4C Q9H3R0 1/20 0.37

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
SCHEMBL306395 1.00 CHRM5 (0.50) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
SCHEMBL472213 1.00 CHRM5 (0.50) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
SCHEMBL27229072 0.98 CHRM5 (0.48) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
SCHEMBL5550813 0.98 CHRM5 (0.48) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
SCHEMBL5239633 0.98 CHRM5 (0.48) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
Hydrochloric Acid SCHEMBL28968883 0.98 CHRM5 (0.48) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
SCHEMBL8038178 0.98 CHRM5 (0.48) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
SCHEMBL6537424 0.98 CHRM5 (0.48) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
SCHEMBL10567168 0.98 CHRM5 (0.48) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9
SCHEMBL337070 0.98 HSD17B10 (0.52) CHRM5CHRM3HSD17B10SIGMAR1SLC6A9

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 2 patents. 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
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 1728/4885HSD17B10 3848/4885

“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.