SCHEMBL20032351

SCHEMBL20032351

CC(=O)NC1C(OC(C)=O)[C@H](OC(C)=O)C(CO)O[C@H]1OC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.52
▸ THRB P10828 1/20 0.52
▸ LMNA P02545 3/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ MAPK1 P28482 2/20 0.45
▸ POLB P06746 2/20 0.45
▸ MMP9 P14780 1/20 0.41
▸ MMP12 P39900 1/20 0.41
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ TLR4 O00206 3/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ LY96 Q9Y6Y9 2/20 0.38
▸ LGALS8 O00214 1/20 0.38

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
SCHEMBL10687435 0.88 LMNA (0.53) ALDH1A1THRBLMNAKMT2AMAPK1
SCHEMBL6324521 0.88 LMNA (0.53) ALDH1A1THRBLMNAKMT2AMAPK1
SCHEMBL6324514 0.88 LMNA (0.53) ALDH1A1THRBLMNAKMT2AMAPK1
SCHEMBL19767509 0.87 LMNA (0.60) ALDH1A1THRBLMNAKMT2APOLB
SCHEMBL15333945 0.87 LMNA (0.60) ALDH1A1THRBLMNAKMT2APOLB
SCHEMBL23046595 0.87 LMNA (0.60) ALDH1A1THRBLMNAKMT2APOLB
SCHEMBL16882358 0.87 LMNA (0.60) ALDH1A1THRBLMNAKMT2APOLB
SCHEMBL18710677 0.87 LMNA (0.60) ALDH1A1THRBLMNAKMT2APOLB
SCHEMBL24219925 0.87 LMNA (0.60) ALDH1A1THRBLMNAKMT2APOLB
SCHEMBL15344529 0.87 LMNA (0.60) ALDH1A1THRBLMNAKMT2APOLB

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-20180094017-A1 OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE CONSTRUCT USING THE SAME, AND METHODS FOR PRODUCING THEM GIFU UNIVERSITY (JP) 2018-04-05 — — 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-20180094017-A1 OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE CONSTRUCT USING THE SAME, AND METHODS FOR PRODUCING THEM APOB, TTPA, AOX1 ALDH1A1 603/4885THRB 1819/4885LMNA 717/4885

“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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