SCHEMBL17732552

SCHEMBL17732552

C=C1NC(=O)C=CN1[C@H]1CC[C@@H](CO)O1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ ALB P02768 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ ABL1 P00519 1/20 0.33
▸ RIN1 Q13671 1/20 0.33
▸ CYP1A2 P05177 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
SCHEMBL25712268 0.90 ALDH1A1 (0.31) ALDH1A1LMNAALBMAPK1
SCHEMBL22525090 0.83 — —
SCHEMBL17732553 0.79 ALDH1A1 (0.38) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL24858818 0.78 POLA1 (0.40) —
SCHEMBL24512490 0.75 TK1 (0.34) LMNACYP1A2
SCHEMBL29323074 0.75 ALDH1A1 (0.44) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL16000610 0.74 — —
SCHEMBL29323172 0.70 ALDH1A1 (0.37) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL25458669 0.70 PYGM (0.44) ALDH1A1LMNA
SCHEMBL18503408 0.69 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240238323-A1 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES EMORY UNIVERSITY 2024-07-18 — — US disclosed
US-9334300-B2 Vitamin B6 derivatives of nucleotides, acyclonucleotides and acyclonucleoside phosphonates MBC PHARMA, INC. (US) 2016-05-10 — — 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-20240238323-A1 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES MTAP, PNP, SARS1 ALDH1A1 1929/4885LMNA 424/4885ALB 239/4885

“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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