SCHEMBL12902015

SCHEMBL12902015

CC(C)O[C@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O)[C@H](O)C2O)C(O)C1O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 6/20 0.56
▸ LGALS8 O00214 1/20 0.54
▸ LGALS3 P17931 1/20 0.54
▸ LGALS4 P56470 1/20 0.54
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ AMY1A P0DUB6 1/20 0.48
▸ PTPN1 P18031 1/20 0.45
▸ AMY2A P04746 1/20 0.44
▸ GJA1 P17302 1/20 0.44
▸ GJB2 P29033 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ TSHR P16473 1/20 0.44

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
SCHEMBL12901988 1.00 TYR (0.56) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL12604931 1.00 TYR (0.56) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL12563491 1.00 TYR (0.56) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL12563490 1.00 TYR (0.56) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL17341181 0.92 TYR (0.48) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL21132597 0.92 MEN1 (0.50) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL10047647 0.92 TYR (0.48) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL15095371 0.92 TYR (0.49) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL15095372 0.92 TYR (0.49) TYRLGALS8LGALS3LGALS4MEN1
SCHEMBL13026650 0.90 TYR (0.48) TYRLGALS8LGALS3LGALS4MEN1

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-20110033422-A1 TREATMENTS FOR FLAVIVIRIDAE VIRUS INFECTION SCHERING CORPORATION 2011-02-10 — — 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-20110033422-A1 TREATMENTS FOR FLAVIVIRIDAE VIRUS INFECTION HAVCR2, EIF2AK2, HNRNPC TYR 3651/4885LGALS8 971/4885LGALS3 504/4885

“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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