SCHEMBL23488255

SCHEMBL23488255

COc1cc(OCc2cccc(CNC(=O)CCCCCCC(=O)NCCCCCC(=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 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
CA1 P00915 1/20 0.35
LGALS3 P17931 3/20 0.34
LGALS7; LGALS7B P47929 2/20 0.34
LGALS1 P09382 1/20 0.34
ABCC8 Q09428 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
LGALS8 O00214 1/20 0.32
EPHX2 P34913 2/20 0.32
LGALS9 O00182 1/20 0.32

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
SCHEMBL23488730 1.00 CYP3A4 (0.35) CYP3A4CA2CA9CA1LGALS3
SCHEMBL23488194 0.97 CA2 (0.36) CA2CA9CA1LGALS3LGALS7; LGALS7B
SCHEMBL23488243 0.97 CA2 (0.36) CA2CA9CA1LGALS3LGALS7; LGALS7B
SCHEMBL23488526 0.96 CA2 (0.37) CA2CA9CA1LGALS3LGALS7; LGALS7B
SCHEMBL23488796 0.93 CA2 (0.38) CA2CA9CA1LGALS3LGALS7; LGALS7B
SCHEMBL23488383 0.93 HDAC8 (0.36) CA2CA9CA1ABCC8
SCHEMBL23486282 0.93 HDAC8 (0.36) CA2CA9CA1ABCC8
SCHEMBL23488696 0.90 KLK7 (0.37) CYP3A4CA2CA9CA1
SCHEMBL23488608 0.90 KLK7 (0.37) CYP3A4CA2CA9CA1
SCHEMBL23488245 0.89 HDAC8 (0.38) CA2CA9CA1

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 CYP3A4 2991/4885CA2 1099/4885CA9 906/4885

“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.