SCHEMBL14200457

SCHEMBL14200457

CC1OC(CO)C(O)C(O)C1NC(=O)CS

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 7/20 0.45
▸ GAA P10253 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ HK1 P19367 1/20 0.36
▸ HK2 P52789 1/20 0.36

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
SCHEMBL12767213 1.00 PYGB (0.45) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL19757480 0.88 PYGB (0.48) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL19757478 0.88 PYGB (0.48) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL23315803 0.88 PYGB (0.48) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL23651957 0.88 PYGB (0.48) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL18391238 0.87 PYGB (0.47) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL24468938 0.86 PYGB (0.62) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL18365283 0.86 PYGB (0.62) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL18390833 0.84 PYGB (0.45) PYGBGAAKDM4ELMNACYP2D6
SCHEMBL16664876 0.84 LMNA (0.55) PYGBGAAKDM4ELMNACYP2D6

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-20080108557-A1 Modified Proteins NOVO NORDISK HEALTHCARE A/G (CH) 2008-05-08 — — 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-20080108557-A1 Modified Proteins PTMS, DNPEP, STT3A PYGB 782/4885GAA 735/4885KDM4E 3955/4885

“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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