SCHEMBL19273575

SCHEMBL19273575

CCC(C)(C)OC1C(C(=O)O)OC(OC2C(O)C(CO)O[C@H](C)C2NC(C)=O)C(O)C1O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 5/20 0.42
▸ LGALS8 O00214 1/20 0.42
▸ LGALS4 P56470 1/20 0.42
▸ MAPK1 P28482 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ MDK P21741 2/20 0.38
▸ PTN P21246 1/20 0.38
▸ BDNF P23560 1/20 0.38
▸ CD69 Q07108 1/20 0.38
▸ AMY2A P04746 1/20 0.37
▸ CHIA Q9BZP6 1/20 0.37
▸ FGF1 P05230 1/20 0.37
▸ LGALS1 P09382 1/20 0.36
▸ LGALS7; LGALS7B P47929 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL18737220 0.90 LGALS3 (0.42) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL18257002 0.87 LGALS3 (0.44) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL19731923 0.87 LGALS3 (0.48) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL17359489 0.86 ALDH1A1 (0.42) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL25121361 0.86 MAPK1 (0.44) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL12085239 0.86 MAPK1 (0.44) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL15215584 0.86 MAPK1 (0.44) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL15082697 0.86 MAPK1 (0.44) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL21374694 0.86 MAPK1 (0.44) LGALS3LGALS8LGALS4MAPK1ALDH1A1
SCHEMBL12213976 0.86 MAPK1 (0.44) LGALS3LGALS8LGALS4MAPK1ALDH1A1

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-20170239358-A1 Rapid In-situ Gel Forming Compositions Prepared via Reaction of Vinyl Sulfone Derivatized Hyaluronic Acid with Thiol Derivatized Polyethylene Glycol at Alkaline pH CARBYLAN THERAPEUTICS, INC. 2017-08-24 — — 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-20170239358-A1 Rapid In-situ Gel Forming Compositions Prepared via Reaction of Vinyl Sulfone Derivatized Hyaluronic Acid with Thiol Derivatized Polyethylene Glycol at Alkaline pH CD44, HPSE, VNN1 LGALS3 1074/4885LGALS8 1565/4885LGALS4 2156/4885

“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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