SCHEMBL23813680

SCHEMBL23813680

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

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 1/20 0.39
▸ CA12 O43570 2/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ TSHR P16473 1/20 0.34
▸ CHRM2 P08172 5/20 0.32
▸ CHRM1 P11229 3/20 0.32
▸ CHRM4 P08173 2/20 0.32
▸ CHRM3 P20309 2/20 0.32
▸ CYP2D6 P10635 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PTPN1 P18031 2/20 0.31
▸ THRB P10828 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL23127812 1.00 OGA (0.39) OGACA12CA1CA2CA9
SCHEMBL19588730 0.85 OGA (0.38) OGACA12CA1CA2CA9
SCHEMBL6200735 0.79 OGA (0.41) OGACA12CA1CA2CA9
SCHEMBL23813691 0.76 CHRM2 (0.36) CHRM2CHRM1CHRM4CHRM3
SCHEMBL25758783 0.75 TSHR (0.38) OGACA12CA1CA2CA9
SCHEMBL22073039 0.74 TSHR (0.33) CA12CA1CA2CA9TSHR
SCHEMBL25070626 0.74 OGA (0.40) OGACA12CA1CA2CA9
SCHEMBL22108031 0.74 SLC18A3 (0.33) —
SCHEMBL23813694 0.74 SLC18A3 (0.33) —
SCHEMBL21339450 0.73 OGA (0.36) OGACA12CA1CA2CA9

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-20210283157-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS SENDA BIOSCIENCES, INC. 2021-09-16 — — 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-20210283157-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS ENPP2, MBOAT7, AADAC OGA 375/4885CA12 495/4885CA1 1148/4885

“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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