SCHEMBL14948817

SCHEMBL14948817

CCOCC1OC(n2c(C#CCOC(=O)CCCS)cc3c(N)ncnc32)C(O)C1O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HSPA5 P11021 3/20 0.42
▸ ADORA3 P0DMS8 2/20 0.39
▸ ATG7 O95352 3/20 0.38
▸ ENTPD1 P49961 1/20 0.38
▸ PRKACA P17612 1/20 0.38
▸ HSPA2 P54652 1/20 0.37
▸ MARS1 P56192 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
SCHEMBL18950207 0.95 HSPA5 (0.43) HSPA5ADORA3ATG7ENTPD1
SCHEMBL18852628 0.92 ADK (0.43) HSPA5ADORA3ATG7PRKACAHSPA2
SCHEMBL17472296 0.90 HSPA8 (0.45) HSPA5ADORA3
SCHEMBL21244328 0.89 ENTPD1 (0.41) HSPA5ADORA3ENTPD1
SCHEMBL15746955 0.84 HSPA5 (0.45) HSPA5ADORA3ATG7
SCHEMBL18531148 0.82 ENTPD1 (0.41) HSPA5ADORA3ENTPD1
SCHEMBL19007434 0.79 HSPA5 (0.46) HSPA5ADORA3ATG7
SCHEMBL12369365 0.79 ATG7 (0.36) ADORA3ATG7
SCHEMBL18464494 0.76 ADK (0.51) HSPA5ADORA3ATG7
SCHEMBL22315144 0.73 ADORA3 (0.51) HSPA5ADORA3ENTPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9814760-B2 Modified polynucleotides for the production of biologics and proteins associated with human disease MODERNATX, INC. (US) 2017-11-14 — — US disclosed
US-20170175129-A1 ALTERNATIVE NUCLEIC ACID MOLECULES AND USES THEREOF MODERNA THERAPEUTICS INC (US) 2017-06-22 — — US disclosed
WO-2015089511-A2 MODIFIED NUCLEIC ACID MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2015-06-18 — — WO disclosed
US-20130123481-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF modeRNA Therapeutics (US) 2013-05-16 — — 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 (2 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-20130123481-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 HSPA5 2318/4885ADORA3 103/4885ATG7 3303/4885
US-20170175129-A1 ALTERNATIVE NUCLEIC ACID MOLECULES AND USES THEREOF NSUN2, RNGTT, NSUN3 HSPA5 1076/4885ADORA3 406/4885ATG7 4279/4885

“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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