SCHEMBL25966027

SCHEMBL25966027

CC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(NC(=O)C(C)C)nc32)[C@H](F)[C@@H]1C

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.52
▸ TAS1R3 Q7RTX0 1/20 0.49
▸ TAS1R1 Q7RTX1 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HINT1 P49773 4/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NT5E P21589 1/20 0.40
▸ TAAR1 Q96RJ0 1/20 0.38
▸ IMPDH2 P12268 4/20 0.38
▸ IMPDH1 P20839 2/20 0.38
▸ POLA1 P09884 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
SCHEMBL20149820 0.93 KDM4E (0.58) KDM4ETAS1R3TAS1R1ALDH1A1HPGD
SCHEMBL25496203 0.92 KDM4E (0.54) KDM4ETAS1R3TAS1R1ALDH1A1HPGD
SCHEMBL26298166 0.91 TAS1R3 (0.53) KDM4ETAS1R3TAS1R1HPGDHINT1
SCHEMBL26298176 0.91 TAS1R3 (0.53) KDM4ETAS1R3TAS1R1HPGDHINT1
SCHEMBL20248735 0.91 TAS1R3 (0.57) KDM4ETAS1R3TAS1R1ALDH1A1HPGD
SCHEMBL19491652 0.91 TAS1R3 (0.57) KDM4ETAS1R3TAS1R1ALDH1A1HPGD
SCHEMBL25496198 0.91 TAS1R3 (0.57) KDM4ETAS1R3TAS1R1ALDH1A1HPGD
SCHEMBL25966020 0.90 KDM4E (0.51) KDM4ETAS1R3TAS1R1ALDH1A1HPGD
SCHEMBL24465153 0.89 TAS1R3 (0.56) KDM4ETAS1R3TAS1R1HPGDHINT1
SCHEMBL18510807 0.89 TAS1R3 (0.56) KDM4ETAS1R3TAS1R1HPGDHINT1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365970-A1 Modified Short Interfering Nucleic Acid (siNA) Molecules and Uses Thereof ALIGOS THERAPEUTICS, INC. (US) 2023-11-16 — — US disclosed
US-20230332153-A1 Modified Short Interfering Nucleic Acid (siNA) Molecules and Uses Thereof ALIGOS THERAPEUTICS, INC. (US) 2023-10-19 — — US disclosed
US-20230203078-A1 SYNTHESIS OF 3'N NUCLEOSIDES THROUGH OXIME INTERMEDIATES AND RELATED COMPOUNDS Janssen Biopharma, Inc. 2023-06-29 — — 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 (3 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-20230365970-A1 Modified Short Interfering Nucleic Acid (siNA) Molecules and Uses Thereof NSUN2, SNRPA, SNRPF KDM4E 3173/4885TAS1R3 4267/4885TAS1R1 4293/4885
US-20230332153-A1 Modified Short Interfering Nucleic Acid (siNA) Molecules and Uses Thereof NSUN2, SNRPA, SNRPF KDM4E 3173/4885TAS1R3 4267/4885TAS1R1 4293/4885
US-20230203078-A1 SYNTHESIS OF 3'N NUCLEOSIDES THROUGH OXIME INTERMEDIATES AND RELATED COMPOUNDS NT5C3B, PNP, NME1 KDM4E 1564/4885TAS1R3 2186/4885TAS1R1 2652/4885

“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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