SCHEMBL26407498

SCHEMBL26407498

CC[C@@H]1CC(C)C[C@@H](O[C@@H]2OC(CO)[C@H](O)C(O[C@@H](CC3CCCCC3)C(=O)N(C)C)C2NC(C)=O)[C@H]1O[C@@H]1OC(C)[C@@H](O)C(O)[C@@H]1O

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SELE P16581 15/20 0.66
▸ SELL P14151 1/20 0.37
▸ LGALS8 O00214 1/20 0.34
▸ LGALS3 P17931 1/20 0.34
▸ LGALS4 P56470 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ THRB P10828 1/20 0.33

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
SCHEMBL22247269 0.93 SELE (0.71) SELESELLLGALS8LGALS3LGALS4
SCHEMBL22400259 0.93 SELE (0.71) SELESELLLGALS8LGALS3LGALS4
SCHEMBL26407401 0.93 SELE (0.71) SELESELLLGALS8LGALS3LGALS4
SCHEMBL25565231 0.93 SELE (0.71) SELESELLLGALS8LGALS3LGALS4
SCHEMBL16659819 0.92 SELE (0.70) SELESELL
SCHEMBL26407465 0.90 SELE (0.70) SELESELL
SCHEMBL26408536 0.90 SELE (0.70) SELESELL
SCHEMBL22898055 0.89 SELE (0.73) SELESELL
SCHEMBL17148785 0.87 SELE (0.74) SELESELLLGALS8LGALS3LGALS4
SCHEMBL17151748 0.87 SELE (0.74) SELESELLLGALS8LGALS3LGALS4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365609-A1 HIGHLY POTENT MULTIMERIC E-SELECTIN ANTAGONISTS GLYCOMIMETICS, INC. (US) 2023-11-16 — — US disclosed
US-11780873-B2 Highly potent multimeric e-selectin antagonists GLYCOMIMETICS, INC. (US) 2023-10-10 — — 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 (2 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-11780873-B2 Highly potent multimeric e-selectin antagonists SELE, SELP, SELPLG SELE 1/4885SELL 4/4885LGALS8 414/4885
US-20230365609-A1 HIGHLY POTENT MULTIMERIC E-SELECTIN ANTAGONISTS SELE, SELP, SELPLG SELE 1/4885SELL 4/4885LGALS8 429/4885

“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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