SCHEMBL21138671

SCHEMBL21138671

CCCC(=O)NC1[C@H](OC(C)=O)OC(COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.65
▸ KMT2A Q03164 1/20 0.54
▸ TGM2 P21980 1/20 0.52
▸ POLB P06746 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ CYP2D6 P10635 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ CYP3A4 P08684 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ CA2 P00918 6/20 0.47
▸ CA12 O43570 5/20 0.47
▸ CA1 P00915 5/20 0.47
▸ CA9 Q16790 5/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ NR3C1 P04150 1/20 0.46
▸ FYN P06241 1/20 0.46
▸ ADRA2A P08913 1/20 0.46

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
SCHEMBL30032874 1.00 LMNA (0.65) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL21058368 1.00 LMNA (0.65) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL25957762 1.00 LMNA (0.65) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL30718114 0.93 LMNA (0.63) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL20788116 0.91 LMNA (0.61) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL15333976 0.91 LMNA (0.61) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL23779761 0.90 LMNA (0.68) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL23777367 0.90 LMNA (0.68) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL23118203 0.90 LMNA (0.68) LMNAKMT2ATGM2POLBALDH1A1
SCHEMBL23118202 0.90 LMNA (0.68) LMNAKMT2ATGM2POLBALDH1A1

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-20190185502-A1 GLUCOSAMINE DERIVATIVES AND PHARMACEUTICAL USES THEREOF RISEN (SUZHOU) PHARMA TECH CO, LTD. (CN) 2019-06-20 — — 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-20190185502-A1 GLUCOSAMINE DERIVATIVES AND PHARMACEUTICAL USES THEREOF OGT, UGGT1, GLA LMNA 2743/4885KMT2A 4171/4885TGM2 231/4885

“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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