SCHEMBL10109103

SCHEMBL10109103

CC(=O)Nc1ccc(O[C@H]2OC(COC(C)=O)[C@@H](OC(C)=O)C(OC(C)=O)C2OC(C)=O)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ POLB P06746 1/20 0.60
▸ CA12 O43570 2/20 0.52
▸ CA1 P00915 2/20 0.52
▸ CA2 P00918 2/20 0.52
▸ CA9 Q16790 2/20 0.52
▸ CA14 Q9ULX7 2/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ THRB P10828 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ TP53 P04637 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ TSHR P16473 1/20 0.51
▸ USP2 O75604 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.50

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
SCHEMBL10109451 1.00 LMNA (0.60) LMNAALDH1A1POLBCA12CA1
SCHEMBL15198254 1.00 LMNA (0.60) LMNAALDH1A1POLBCA12CA1
SCHEMBL15700901 0.91 ALDH1A1 (0.56) LMNAALDH1A1POLBCA12CA1
SCHEMBL10109274 0.91 ALDH1A1 (0.56) LMNAALDH1A1POLBCA12CA1
SCHEMBL15198152 0.91 ALDH1A1 (0.56) LMNAALDH1A1POLBCA12CA1
SCHEMBL15700872 0.91 ALDH1A1 (0.56) LMNAALDH1A1POLBCA12CA1
SCHEMBL15198155 0.91 ALDH1A1 (0.56) LMNAALDH1A1POLBCA12CA1
SCHEMBL10109607 0.89 LMNA (0.56) LMNAALDH1A1POLBCA12CA1
SCHEMBL15198143 0.89 LMNA (0.56) LMNAALDH1A1POLBCA12CA1
SCHEMBL15700845 0.89 LMNA (0.58) LMNAALDH1A1POLBCA12CA1

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-20120022012-A1 Glycosylated Acetaminophen Pro-Drug Analogs NuTek Pharma Ltd. 2012-01-26 — — 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-20120022012-A1 Glycosylated Acetaminophen Pro-Drug Analogs UGT1A3, GCG, UGT1A1 LMNA 1396/4885ALDH1A1 282/4885POLB 3969/4885

“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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