SCHEMBL23488232

SCHEMBL23488232

COc1cc(OCc2cccc(OCCCCCC(=O)OC(C)(C)C)c2)c(Cl)cc1C(=O)N[C@H]1[C@@H](OC)O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CA1 P00915 1/20 0.39
LGALS3 P17931 4/20 0.36
LGALS1 P09382 2/20 0.35
LGALS7; LGALS7B P47929 2/20 0.35
LGALS8 O00214 2/20 0.35
LGALS9 O00182 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL23488767 0.97 CA2 (0.38) CA2CA9CA1LGALS3LGALS1
SCHEMBL23488756 0.92 CA2 (0.41) CA2CA9CA1LGALS3LGALS1
SCHEMBL23488605 0.90 HDAC8 (0.38) CA2CA9CA1MEN1KMT2A
SCHEMBL23488243 0.90 CA2 (0.36) CA2CA9CA1LGALS3LGALS1
SCHEMBL23488245 0.90 HDAC8 (0.38) CA2CA9CA1MEN1KMT2A
SCHEMBL23488194 0.90 CA2 (0.36) CA2CA9CA1LGALS3LGALS1
SCHEMBL23488354 0.89 CA2 (0.41) CA2CA9CA1LGALS3LGALS1
SCHEMBL23488526 0.88 CA2 (0.37) CA2CA9CA1LGALS3LGALS1
SCHEMBL23488372 0.88 EGFR (0.37) CA2CA9CA1
SCHEMBL23488255 0.87 CYP3A4 (0.35) CA2CA9CA1LGALS3LGALS1

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-20210170033-A1 NOVEL CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2021-06-10 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 (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-20210170033-A1 NOVEL CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN GPR119, SLC2A8, SLC2A4 CA2 1099/4885CA9 906/4885CA1 2052/4885

“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.