SCHEMBL26428735

SCHEMBL26428735

CCOC(=O)C1=CCCCC1S(=O)(=O)Nc1c(F)cc(COC(=O)S)cc1F

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 9/20 0.65
HPGD P15428 3/20 0.33
ALDH1A1 P00352 1/20 0.33
RECQL P46063 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MAPT P10636 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RAB9A P51151 2/20 0.31
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL26446044 0.89 TLR4 (0.61) TLR4HPGDALDH1A1RECQLCA1
SCHEMBL26428772 0.87 TLR4 (0.58) TLR4HPGDALDH1A1RECQLCA1
SCHEMBL23417930 0.84 TLR4 (0.62) TLR4HPGDALDH1A1GAA
SCHEMBL23417853 0.83 TLR4 (0.51) TLR4
SCHEMBL23417821 0.83 TLR4 (0.52) TLR4RAB9A
SCHEMBL872983 0.82 TLR4 (0.70) TLR4HPGDALDH1A1RECQLCA1
SCHEMBL873524 0.81 TLR4 (0.68) TLR4HPGDALDH1A1RECQLCA1
SCHEMBL26422997 0.81 TLR4 (0.51) TLR4
SCHEMBL871345 0.81 TLR4 (0.71) TLR4HPGDALDH1A1RECQLCA1
SCHEMBL872345 0.81 TLR4 (0.76) TLR4HPGDRECQLMAPTNPSR1

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-20230128688-A1 DIRECTED CONJUGATION TECHNOLOGIES KLEO PHARMACEUTICALS, INC. 2023-04-27 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-20230128688-A1 DIRECTED CONJUGATION TECHNOLOGIES CD2BP2, CD2, CD47 TLR4 3806/4885HPGD 4378/4885ALDH1A1 1047/4885

“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.