SCHEMBL29299512

SCHEMBL29299512

C=C(O)CN1CCCN(CC(=O)O)CCN(CC(=O)O)CCCN(CC(=O)O)CC1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.47
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
STAT6 P42226 1/20 0.39
GAA P10253 1/20 0.39
SLC6A9 P48067 1/20 0.38
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 1/20 0.36
SIGMAR1 Q99720 3/20 0.34
S1PR1 P21453 1/20 0.33
ITGB3 P05106 1/20 0.33
ITGA2B P08514 1/20 0.33
HTT P42858 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 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
SCHEMBL12014964 0.93 HSD17B10 (0.52) HSD17B10ALDH1A1SMN1; SMN2STAT6GAA
SCHEMBL24626085 0.93 HSD17B10 (0.52) HSD17B10ALDH1A1SMN1; SMN2STAT6GAA
SCHEMBL893723 0.89 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2GAASLC6A9
SCHEMBL21454626 0.89 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2GAASLC6A9
SCHEMBL1065178 0.89 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2GAASLC6A9
SCHEMBL454245 0.89 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2GAASLC6A9
SCHEMBL321552 0.89 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2GAASLC6A9
SCHEMBL17512849 0.89 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2GAASLC6A9
SCHEMBL336249 0.89 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2GAASLC6A9
SCHEMBL3504659 0.89 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2GAASLC6A9

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 HSD17B10 3848/4885ALDH1A1 3906/4885SMN1; SMN2 3725/4885

“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.