SCHEMBL16393089

SCHEMBL16393089

CC(=O)CCNC(=O)NC1OC(CO)C(O)C(O)C1NC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ CD69 Q07108 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ PYGB P11216 4/20 0.43
▸ GAA P10253 1/20 0.42
▸ MMP9 P14780 1/20 0.40
▸ MMP12 P39900 1/20 0.40

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
SCHEMBL11518816 0.87 PYGB (0.48) CA1CA2CA9ALDH1A1THRB
SCHEMBL11518820 0.87 PYGB (0.48) CA1CA2CA9ALDH1A1THRB
SCHEMBL9302995 0.83 CA1 (0.60) CA1CA2CA9ALDH1A1THRB
SCHEMBL9302990 0.83 CA1 (0.60) CA1CA2CA9ALDH1A1THRB
SCHEMBL16393092 0.81 PYGB (0.53) CA1CA2CA9ALDH1A1THRB
SCHEMBL14081291 0.78 ALDH1A1 (0.53) CA1CA2CA9ALDH1A1THRB
SCHEMBL25511170 0.78 ALDH1A1 (0.53) CA1CA2CA9ALDH1A1THRB
SCHEMBL16217717 0.78 ALDH1A1 (0.53) CA1CA2CA9ALDH1A1THRB
SCHEMBL13308253 0.77 PYGB (0.70) CA1CA2CA9ALDH1A1THRB
SCHEMBL18934182 0.76 PYGB (0.68) CA1CA2CA9ALDH1A1THRB

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-10808246-B2 Oligonucleotide-ligand conjugates and process for their preparation ALNYLAM PHARMACEUTICALS, INC. (US) 2020-10-20 — — US disclosed
WO-2015006740-A2 OLIGONUCLEOTIDE-LIGAND CONJUGATES AND PROCESS FOR THEIR PREPARATION ALNYLAM PHARMACEUTICALS, INC. (US) 2015-01-15 — — WO 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-10808246-B2 Oligonucleotide-ligand conjugates and process for their preparation RTCB, IGF2BP2, SNRPE CA1 4719/4885CA2 4856/4885CA9 3205/4885

“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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