SCHEMBL16640654

SCHEMBL16640654

COC1OC(CO)C(OP(C)(=O)O)C(O)C1NC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 8/20 0.51
▸ LGALS7; LGALS7B P47929 3/20 0.51
▸ LGALS1 P09382 1/20 0.51
▸ LGALS9 O00182 3/20 0.49
▸ ALDH1A1 P00352 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ LGALS8 O00214 2/20 0.45
▸ LGALS4 P56470 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ CD69 Q07108 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 1/20 0.43

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
SCHEMBL26359459 0.89 MAPK1 (0.52) LGALS3LGALS7; LGALS7BLGALS1LGALS9ALDH1A1
SCHEMBL16640655 0.86 MAPK1 (0.51) LGALS3LGALS7; LGALS7BLGALS1ALDH1A1THRB
SCHEMBL29305312 0.86 LGALS3 (0.54) LGALS3LGALS7; LGALS7BLGALS1LGALS9ALDH1A1
SCHEMBL16476751 0.86 LGALS3 (0.54) LGALS3LGALS7; LGALS7BLGALS1LGALS9ALDH1A1
SCHEMBL7153592 0.86 LGALS3 (0.54) LGALS3LGALS7; LGALS7BLGALS1LGALS9ALDH1A1
SCHEMBL16476748 0.86 LGALS3 (0.54) LGALS3LGALS7; LGALS7BLGALS1LGALS9ALDH1A1
SCHEMBL7153589 0.86 LGALS3 (0.54) LGALS3LGALS7; LGALS7BLGALS1LGALS9ALDH1A1
SCHEMBL28851367 0.83 LGALS8 (0.50) LGALS3LGALS8
SCHEMBL16675413 0.81 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9ALDH1A1
SCHEMBL13784257 0.81 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9ALDH1A1

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-20150104479-A1 MENINGOCOCCUS SEROGROUP X CONJUGATE NOVARTIS AG (CH) 2015-04-16 — — US disclosed
US-20150104479-A1 MENINGOCOCCUS SEROGROUP X CONJUGATE NOVARTIS AG (CH) 2015-04-16 — — 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-20150104479-A1 MENINGOCOCCUS SEROGROUP X CONJUGATE O60361, MLEC, PDHX LGALS3 1740/4885LGALS7; LGALS7B 2193/4885LGALS1 1651/4885

“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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