SCHEMBL25605688

SCHEMBL25605688

CO[C@@H]1[C@H](C)[C@@H](C(=O)OC(C)(C)C)O[C@H]1n1cnc2c(=O)[nH]c(NC(=O)C(C)C)nc21

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.47
▸ TAS1R3 Q7RTX0 1/20 0.42
▸ TAS1R1 Q7RTX1 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ TAAR1 Q96RJ0 2/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37
▸ AHCY P23526 2/20 0.34
▸ ACHE P22303 1/20 0.34
▸ IMPDH2 P12268 1/20 0.34
▸ IMPDH1 P20839 1/20 0.34
▸ STING1 Q86WV6 1/20 0.33
▸ HINT1 P49773 1/20 0.33

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
SCHEMBL26554141 0.89 KDM4E (0.47) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL25613004 0.89 KDM4E (0.44) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL25605696 0.85 KDM4E (0.49) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL24487848 0.84 KDM4E (0.49) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL26553761 0.84 KDM4E (0.49) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL25605689 0.83 KDM4E (0.58) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL25605690 0.83 KDM4E (0.53) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL24487755 0.83 KDM4E (0.44) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL24487846 0.82 KDM4E (0.49) KDM4ETAS1R3TAS1R1ALDH1A1MEN1
SCHEMBL26553767 0.82 KDM4E (0.49) KDM4ETAS1R3TAS1R1ALDH1A1MEN1

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-20230159929-A1 MODIFIED SHORT INTERFERING NUCLEIC ACID (siNA) MOLECULES AND USES THEREOF ALIGOS THERAPEUTICS, INC. 2023-05-25 — — 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-20230159929-A1 MODIFIED SHORT INTERFERING NUCLEIC ACID (siNA) MOLECULES AND USES THEREOF SNRPA, SNRPA1, NSUN2 KDM4E 4623/4885TAS1R3 3510/4885TAS1R1 3703/4885

“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.

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