SCHEMBL29299846

SCHEMBL29299846

CC(C)CCOCCNC(=O)C1OC(CNC(C)C)C(O)C(O)C1O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HOGA1 Q86XE5 1/20 0.32
▸ LGALS3 P17931 1/20 0.30

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
SCHEMBL29302102 0.89 HOGA1 (0.34) ADORA3MEN1KMT2AHOGA1
SCHEMBL27391612 0.86 ADORA3 (0.31) ADORA3MEN1KMT2A
SCHEMBL27391516 0.85 HOGA1 (0.35) ADORA3HOGA1
SCHEMBL29299804 0.82 FOLH1 (0.37) —
SCHEMBL29299618 0.74 ADORA3 (0.36) ADORA3HOGA1
SCHEMBL29300368 0.73 IDUA (0.36) ADORA3
SCHEMBL29302098 0.72 FOLH1 (0.34) ADORA3MEN1KMT2AHOGA1
SCHEMBL19784356 0.72 HOGA1 (0.39) HOGA1LGALS3
SCHEMBL20888674 0.72 HOGA1 (0.39) HOGA1LGALS3
SCHEMBL27391428 0.72 HOGA1 (0.39) HOGA1LGALS3

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 ADORA3 1203/4885MEN1 601/4885KMT2A 3160/4885

“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.

Send feedback