SCHEMBL19852803

SCHEMBL19852803

CC(=O)N[C@H]1C(OC(C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1OC1OC(C(=O)O)[C@@H](OC(C)(C)C)[C@H](O)[C@H]1O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 6/20 0.45
▸ LGALS8 O00214 1/20 0.45
▸ LGALS4 P56470 1/20 0.45
▸ MDK P21741 3/20 0.44
▸ BDNF P23560 3/20 0.44
▸ PTN P21246 2/20 0.44
▸ MAPK1 P28482 2/20 0.43
▸ CD69 Q07108 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ CHIA Q9BZP6 1/20 0.39
▸ LGALS1 P09382 1/20 0.38
▸ LGALS7; LGALS7B P47929 1/20 0.38
▸ FGF1 P05230 1/20 0.38
▸ FGF2 P09038 1/20 0.38
▸ VEGFA P15692 1/20 0.38
▸ HPSE Q9Y251 1/20 0.38
▸ LGALS9 O00182 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL25645148 0.93 LGALS3 (0.51) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL23280964 0.92 LGALS3 (0.43) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL26479163 0.91 MDK (0.45) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL22137175 0.91 LGALS3 (0.42) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL20291137 0.89 LGALS3 (0.45) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL24036373 0.89 MDK (0.51) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL20290392 0.88 LGALS3 (0.42) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL18386460 0.88 LGALS3 (0.40) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL19221227 0.88 LGALS3 (0.42) LGALS3LGALS8LGALS4MDKBDNF
SCHEMBL20998797 0.88 LGALS3 (0.55) LGALS3LGALS8LGALS4MAPK1CD69

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-20180036419-A1 POLYMER-DRUG CONJUGATES FOR COMBINATION ANTICANCER THERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-02-08 — — 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-20180036419-A1 POLYMER-DRUG CONJUGATES FOR COMBINATION ANTICANCER THERAPY TOP2A, TOP1, TOP2B LGALS3 2990/4885LGALS8 3313/4885LGALS4 3879/4885

“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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