SCHEMBL23041863

SCHEMBL23041863

C=CC[C@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](n2cc(-c3cc(F)c(F)c(F)c3)nn2)[C@H]1OC

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 7/20 0.44
▸ CA2 P00918 7/20 0.44
▸ CA9 Q16790 7/20 0.44
▸ CA12 O43570 4/20 0.44
▸ CA14 Q9ULX7 4/20 0.44
▸ LGALS3 P17931 13/20 0.42

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
SCHEMBL29708140 0.97 CA1 (0.47) CA1CA2CA9CA12CA14
SCHEMBL29510961 0.97 CA1 (0.47) CA1CA2CA9CA12CA14
SCHEMBL26977490 0.94 CA1 (0.44) CA1CA2CA9CA12CA14
SCHEMBL26978097 0.94 LGALS3 (0.44) CA1CA2CA9CA12CA14
SCHEMBL26977569 0.91 CA1 (0.43) CA1CA2CA9CA12CA14
SCHEMBL28755721 0.90 LGALS3 (0.42) LGALS3
SCHEMBL29510953 0.89 CA1 (0.47) CA1CA2CA9CA12CA14
SCHEMBL29511012 0.87 CA1 (0.46) CA1CA2CA9CA12CA14
SCHEMBL23950966 0.87 CA1 (0.47) CA1CA2CA9CA12CA14
SCHEMBL22981049 0.87 CA1 (0.47) CA1CA2CA9CA12CA14

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250257056-A1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2025-08-14 — — US disclosed
US-12319672-B2 Alpha-D-galactopyranoside derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2025-06-03 — — US disclosed
US-12312362-B2 Spiro derivatives of Alpha-D-galactopyranosides IDORSIA PHARMACEUTICALS LTD (CH) 2025-05-27 — — US disclosed
EP-4225752-B1 SPIRO DERIVATIVES OF ALPHA-D-GALACTOPYRANOSIDES IDORSIA PHARMACEUTICALS LTD (CH) 2024-12-11 — — EP disclosed
EP-4021904-B1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2024-01-03 — — EP disclosed
US-20230295182-A1 SPIRO DERIVATIVES OF ALPHA-D-GALACTOPYRANOSIDES IDORSIA PHARMACEUTICALS LTD (CH) 2023-09-21 — — US disclosed
EP-4225752-A1 SPIRO DERIVATIVES OF ALPHA-D-GALACTOPYRANOSIDES Idorsia Pharmaceuticals Ltd (CH) 2023-08-16 — — EP disclosed
US-20220281855-A1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2022-09-08 — — US disclosed
EP-4021904-A1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES Idorsia Pharmaceuticals Ltd (CH) 2022-07-06 — — EP disclosed
WO-2022073969-A1 SPIRO DERIVATIVES OF ALPHA-D-GALACTOPYRANOSIDES IDORSIA PHARMACEUTICALS LTD (CH) 2022-04-14 — — WO disclosed
WO-2021038068-A1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2021-03-04 — — WO 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 (5 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-20250257056-A1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES LGALS1, LGALS3, LGALS2 CA1 2514/4885CA2 1967/4885CA9 1535/4885
US-20220281855-A1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES LGALS1, LGALS3, LGALS2 CA1 1135/4885CA2 777/4885CA9 471/4885
US-12312362-B2 Spiro derivatives of Alpha-D-galactopyranosides LGALS1, LGALS3, LGALS2 CA1 2222/4885CA2 2225/4885CA9 1581/4885
US-12319672-B2 Alpha-D-galactopyranoside derivatives LGALS1, LGALS3, LGALS2 CA1 1135/4885CA2 777/4885CA9 471/4885
US-20230295182-A1 SPIRO DERIVATIVES OF ALPHA-D-GALACTOPYRANOSIDES LGALS1, LGALS3, LGALS2 CA1 2222/4885CA2 2225/4885CA9 1581/4885

“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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