SCHEMBL21316636

SCHEMBL21316636

CCC(CC)C1OC(CO)C(O)C(OC2OC(C(=O)O)C(OC(C)(CC)CC)C(O)C2O)C1NC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.42
▸ THRB P10828 1/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ LGALS3 P17931 5/20 0.40
▸ LGALS8 O00214 1/20 0.40
▸ LGALS4 P56470 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MDK P21741 2/20 0.37
▸ PTN P21246 1/20 0.37
▸ BDNF P23560 1/20 0.37
▸ FGF1 P05230 1/20 0.36
▸ CD69 Q07108 1/20 0.36
▸ CHIA Q9BZP6 1/20 0.35
▸ LGALS1 P09382 1/20 0.34
▸ LGALS7; LGALS7B P47929 1/20 0.34
▸ MAG P20916 1/20 0.34

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
SCHEMBL23137009 0.88 MDK (0.50) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL20291137 0.88 LGALS3 (0.45) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL18088855 0.88 ALDH1A1 (0.43) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL17359489 0.87 ALDH1A1 (0.42) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL20662400 0.86 ALDH1A1 (0.44) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL21316642 0.86 LGALS3 (0.42) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL22598693 0.86 MDK (0.45) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL19928682 0.86 LGALS3 (0.42) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL19749908 0.86 ALDH1A1 (0.44) ALDH1A1THRBMAPK1LGALS3LGALS8
SCHEMBL22472735 0.86 LGALS3 (0.42) ALDH1A1THRBMAPK1LGALS3LGALS8

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-10398636-B2 Deuterium-enriched hyaluronan Deuteria Biomaterials (US) 2019-09-03 — — 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-10398636-B2 Deuterium-enriched hyaluronan DOHH, CD44, HDHD5 ALDH1A1 721/4885THRB 3603/4885MAPK1 4228/4885

“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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