SCHEMBL26443696

SCHEMBL26443696

COC(=O)CCCO[C@@H]1OC(COC(=O)c2ccccc2)[C@@H](C)[C@H](C)C1OC(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PTPN1 P18031 7/20 0.39
▸ TNF P01375 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ SELP P16109 2/20 0.36
▸ F11 P03951 2/20 0.36
▸ XDH P47989 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ LGALS9 O00182 1/20 0.35
▸ LGALS1 P09382 1/20 0.35
▸ LGALS3 P17931 1/20 0.35
▸ LGALS7; LGALS7B P47929 1/20 0.35
▸ PTPN2 P17706 1/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ ELANE P08246 1/20 0.35

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
SCHEMBL26445758 0.90 PTPN1 (0.47) MEN1USP2POLBKMT2APTPN1
SCHEMBL26445770 0.90 PTPN1 (0.47) MEN1USP2POLBKMT2APTPN1
SCHEMBL16559639 0.88 MEN1 (0.40) MEN1USP2POLBKMT2APTPN1
SCHEMBL19473211 0.88 MEN1 (0.40) MEN1USP2POLBKMT2APTPN1
SCHEMBL16849996 0.87 LMNA (0.40) POLBKMT2ATNFALDH1A1SELP
SCHEMBL16559641 0.87 MEN1 (0.39) MEN1USP2POLBKMT2APTPN1
SCHEMBL19473213 0.87 MEN1 (0.39) MEN1USP2POLBKMT2APTPN1
SCHEMBL16902761 0.87 TDP1 (0.40) MEN1USP2POLBKMT2APTPN1
SCHEMBL19473210 0.86 USP2 (0.40) MEN1USP2POLBKMT2APTPN1
SCHEMBL19473217 0.85 MEN1 (0.38) MEN1USP2POLBKMT2APTPN1

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-20230134986-A1 GLUCOSE TRIPTOLIDE CONJUGATES AND USES THEREOF SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2023-05-04 — — 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-20230134986-A1 GLUCOSE TRIPTOLIDE CONJUGATES AND USES THEREOF SLC2A1, SLC2A9, GID4 MEN1 3088/4885USP2 1955/4885POLB 3826/4885

“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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