SCHEMBL23906506

SCHEMBL23906506

CC1(C)OC2C(O1)[C@@H](CO)O[C@H]2N1C=CC(=O)NC1O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ PI4KA P42356 1/20 0.40
▸ PI4K2B Q8TCG2 1/20 0.40
▸ PI4K2A Q9BTU6 1/20 0.40
▸ PI4KB Q9UBF8 1/20 0.40
▸ CDA P32320 4/20 0.33
▸ SLC28A1 O00337 1/20 0.33
▸ SLC28A2 O43868 1/20 0.33
▸ SLC29A1 Q99808 1/20 0.33
▸ SLC28A3 Q9HAS3 1/20 0.33
▸ TYMP P19971 2/20 0.32
▸ HPGD P15428 1/20 0.31
▸ PYGM P11217 1/20 0.31

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
SCHEMBL23898246 0.83 HPGD (0.37) ALDH1A1HPGD
SCHEMBL23906501 0.80 ALDH1A1 (0.41) ALDH1A1LMNATDP1PI4KAPI4K2B
SCHEMBL21283173 0.79 CDA (0.47) LMNACDASLC28A1SLC28A2SLC29A1
SCHEMBL22179130 0.79 ALDH1A1 (0.40) ALDH1A1LMNATDP1PI4KAPI4K2B
SCHEMBL26798971 0.79 CDA (0.39) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL24780304 0.78 HPGD (0.34) ALDH1A1HPGD
SCHEMBL24781002 0.78 ALDH1A1 (0.34) ALDH1A1LMNAHPGD
SCHEMBL26287997 0.77 — —
SCHEMBL18573808 0.76 ALDH1A1 (0.38) ALDH1A1LMNATDP1PI4KAPI4K2B
SCHEMBL21283066 0.76 TK2 (0.37) CDASLC28A1SLC28A2SLC29A1SLC28A3

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-20210308283-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNA THERAPEUTICS, INC. 2021-10-07 — — 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-20210308283-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 ALDH1A1 2620/4885LMNA 585/4885TDP1 160/4885

“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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