SCHEMBL19892602

SCHEMBL19892602

CC(=O)NC1C(OC2C(C(=O)O)OC(O)C(O)C2O)OC(CO)C(O)C1OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.45
▸ CD69 Q07108 1/20 0.45
▸ MDK P21741 3/20 0.42
▸ BDNF P23560 3/20 0.42
▸ PTN P21246 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ LGALS3 P17931 4/20 0.41
▸ LGALS8 O00214 1/20 0.41
▸ LGALS4 P56470 1/20 0.41
▸ CHIA Q9BZP6 1/20 0.41
▸ FGF1 P05230 1/20 0.39

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
SCHEMBL20841393 0.90 MAPK1 (0.44) MAPK1CD69MDKBDNFPTN
SCHEMBL19255224 0.88 MAPK1 (0.47) MAPK1CD69MDKBDNFPTN
SCHEMBL19852803 0.88 LGALS3 (0.45) MAPK1CD69MDKBDNFPTN
SCHEMBL26479163 0.87 MDK (0.45) MAPK1CD69MDKBDNFPTN
SCHEMBL3044786 0.87 CD69 (0.57) MAPK1CD69MDKALDH1A1THRB
SCHEMBL9541269 0.87 CD69 (0.57) MAPK1CD69MDKALDH1A1THRB
SCHEMBL30259462 0.87 CD69 (0.57) MAPK1CD69MDKALDH1A1THRB
SCHEMBL19892618 0.85 MAPK1 (0.55) MAPK1CD69MDKBDNFPTN
SCHEMBL23280964 0.83 LGALS3 (0.43) MAPK1CD69MDKBDNFPTN
SCHEMBL22137175 0.82 LGALS3 (0.42) MAPK1CD69MDKBDNFPTN

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-20180051100-A1 Hyaluronic Acid Derivatives QUEEN'S UNIVERSITY AT KINGSTON (CA) 2018-02-22 — — 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-20180051100-A1 Hyaluronic Acid Derivatives CD44, FUT6, FUT5 MAPK1 3327/4885CD69 1142/4885MDK 943/4885

“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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