SCHEMBL26442012

SCHEMBL26442012

CC(=O)O[C@@H]1C[C@H](OC(C)=O)[C@H](C)[C@H](C)O1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
CHRM2 P08172 5/20 0.34
CA9 Q16790 4/20 0.34
CHRM1 P11229 3/20 0.34
CA12 O43570 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CHRM4 P08173 2/20 0.34
CHRM3 P20309 2/20 0.34
MEN1 O00255 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL10819181 1.00 TSHR (0.53) TSHRCHRM2CA9CHRM1CA12
SCHEMBL14601506 0.89 TSHR (0.56) TSHRCHRM2CA9CHRM1CA12
SCHEMBL26442009 0.88 TSHR (0.41) TSHRCHRM2CA9CHRM1CA12
SCHEMBL13296956 0.85 TSHR (0.53) TSHRCHRM2CA9CHRM1CA12
SCHEMBL21339698 0.85 TSHR (0.53) TSHRCHRM2CA9CHRM1CA12
SCHEMBL18490894 0.85 TSHR (0.53) TSHRCHRM2CA9CHRM1CA12
SCHEMBL30184333 0.85 TSHR (0.53) TSHRCHRM2CA9CHRM1CA12
SCHEMBL2101466 0.85 TSHR (0.53) TSHRCHRM2CA9CHRM1CA12
SCHEMBL26442086 0.84 TSHR (0.38) TSHRCA9CA12CA1CA2
SCHEMBL14049458 0.81 TSHR (0.53) TSHRCHRM2CA9CHRM1CA12

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-20230137021-A1 Drug Conjugates of Sugar Derivatives and Uses Thereof as Senolytic Agents Rubedo Life Sciences, Inc. 2023-05-04 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-20230137021-A1 Drug Conjugates of Sugar Derivatives and Uses Thereof as Senolytic Agents AGER, SENP6, SENP3 TSHR 2431/4885CHRM2 851/4885CA9 1672/4885

“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.