SCHEMBL19409276

SCHEMBL19409276

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

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CA9 Q16790 2/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ TSHR P16473 1/20 0.31
▸ CYP3A4 P08684 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
SCHEMBL1258412 0.82 CA9 (0.42) CA9CA12CA1CA2TSHR
SCHEMBL17273886 0.79 OGA (0.30) —
SCHEMBL17472194 0.79 OGA (0.30) —
SCHEMBL15258387 0.77 CA9 (0.46) CA9CA12CA1CA2TSHR
SCHEMBL1259563 0.76 CA9 (0.42) CA9CA12CA1CA2TSHR
SCHEMBL11249103 0.75 CA9 (0.49) CA9CA12CA1CA2TSHR
SCHEMBL26759992 0.75 PDPK1 (0.36) TSHR
SCHEMBL17265253 0.74 — —
SCHEMBL17266924 0.74 OGA (0.37) CA9CA12CA1CA2
SCHEMBL23563178 0.73 CA9 (0.51) CA9CA12CA1CA2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3357931-B1 METHODS OF SYNTHESIS OF TRITERPENE PROSAPOGENINS AND TRITERPENE SAPONINS SLOAN KETTERING INST CANCER RES (US) 2020-07-22 — — EP disclosed
EP-3357931-A1 METHODS OF SYNTHESIS OF TRITERPENE PROSAPOGENINS AND TRITERPENE SAPONINS Sloan Kettering Institute For Cancer Research (US) 2018-08-08 — — EP disclosed
EP-2280987-B1 TRITERPENE SAPONINS, METHODS OF SYNTHESIS, AND USES THEREOF SLOAN KETTERING INST CANCER RES (US) 2018-05-23 — — EP disclosed
US-20170283450-A1 TRITERPENE SAPONINS, METHODS OF SYNTHESIS AND USES THEREOF MEMORIAL SLOAN-KETTERING INST FOR CANCER RES (US) 2017-10-05 — — 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-20170283450-A1 TRITERPENE SAPONINS, METHODS OF SYNTHESIS AND USES THEREOF LSS, CYP51A1, TLR7 CA9 3028/4885CA12 1541/4885CA1 1970/4885

“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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