SCHEMBL6540099

SCHEMBL6540099

COc1ccccc1S(=O)(=O)c1ccc(CCN(Cc2ccccc2)C(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.55
CA12 O43570 6/20 0.48
CA1 P00915 6/20 0.48
CA2 P00918 6/20 0.48
CA4 P22748 3/20 0.48
RCE1 Q9Y256 1/20 0.48
TAS2R14 Q9NYV8 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LPAR1 Q92633 3/20 0.47
LPAR5 Q9H1C0 2/20 0.47
LIMK1 P53667 1/20 0.46
LIMK2 P53671 1/20 0.46
NAMPT P43490 1/20 0.45

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
SCHEMBL6541428 0.85 L3MBTL1 (0.58) CA12CA1CA2CA4TAS2R14
SCHEMBL6540868 0.84 LPAR1 (0.55) CA12CA1CA2CA4LPAR1
SCHEMBL6540792 0.83 CA12 (0.55) CA12CA1CA2CA4RCE1
SCHEMBL6540559 0.80 LPAR1 (0.56) CA12CA1CA2CA4RCE1
SCHEMBL6798502 0.79 CA12 (0.55) CA12CA1CA2CA4RCE1
SCHEMBL6540809 0.78 CA12 (0.42) CA12CA1CA2CA4RCE1
SCHEMBL6540096 0.77 LPAR1 (0.54) CA12CA1CA2CA4GAA
SCHEMBL6540059 0.76 L3MBTL1 (0.49) RCE1L3MBTL1LPAR1LPAR5
SCHEMBL6540116 0.76 TAS2R14 (0.52) HTR6TAS2R14ALDH1A1LPAR1LPAR5
SCHEMBL6540329 0.76 TAS2R14 (0.54) CA12CA1CA2CA4RCE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 US disclosed
EP-1389185-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-02-18 EP disclosed
WO-2002094770-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-28 WO 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 HTR6 522/4885CA12 4283/4885CA1 4181/4885

“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.