SCHEMBL25974170

SCHEMBL25974170

CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1Cc1cn(C(C)(C)C)nn1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 4/20 0.45
▸ CA2 P00918 4/20 0.45
▸ CA9 Q16790 4/20 0.45
▸ CA12 O43570 2/20 0.45
▸ CA14 Q9ULX7 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ LGALS3 P17931 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ LGALS9 O00182 1/20 0.38

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
SCHEMBL25976612 1.00 CA1 (0.45) CA1CA2CA9CA12CA14
SCHEMBL24916691 0.86 CA1 (0.47) CA1CA2CA9CA12CA14
SCHEMBL30980728 0.76 LGALS3 (0.54) CA1CA2CA9CA12CA14
SCHEMBL12936319 0.73 ALDH1A1 (0.58) CA1CA2CA9ALDH1A1THRB
SCHEMBL17771655 0.73 ALDH1A1 (0.58) CA1CA2CA9ALDH1A1THRB
SCHEMBL25974160 0.72 CA1 (0.64) CA1CA2CA9CA12CA14
SCHEMBL25974166 0.71 ALDH1A1 (0.51) CA1CA2CA9ALDH1A1THRB
SCHEMBL25976611 0.71 ALDH1A1 (0.51) CA1CA2CA9ALDH1A1THRB
SCHEMBL13296076 0.71 HRAS (0.52) —
SCHEMBL18735615 0.69 ALDH1A1 (0.58) CA1CA2CA9ALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250091-A1 ASGPR CELL SURFACE RECEPTOR BINDING COMPOUNDS AND CONJUGATES LYCIA THERAPEUTICS, INC. 2023-08-10 — — US disclosed
US-20230250091-A1 ASGPR CELL SURFACE RECEPTOR BINDING COMPOUNDS AND CONJUGATES LYCIA THERAPEUTICS, INC. 2023-08-10 — — 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-20230250091-A1 ASGPR CELL SURFACE RECEPTOR BINDING COMPOUNDS AND CONJUGATES ASGR1, LAMP2, FCGR2A CA1 3349/4885CA2 3029/4885CA9 2292/4885

“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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