SCHEMBL6540465

SCHEMBL6540465

COc1ccccc1S(=O)(=O)c1ccc(CCNCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.58
CA12 O43570 5/20 0.58
CA1 P00915 5/20 0.58
CA2 P00918 5/20 0.58
CA9 Q16790 4/20 0.58
CA4 P22748 4/20 0.58
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
ATM Q13315 1/20 0.54
BCHE P06276 5/20 0.50
NAMPT P43490 1/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
HTT P42858 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL6554088 0.86 CA1 (0.53) HTR6CA12CA1CA2CA9
SCHEMBL6541333 0.84 CA12 (0.65) CA12CA1CA2CA9CA4
SCHEMBL6554086 0.84 CA1 (0.51) CA12CA1CA2CA9CA4
SCHEMBL6541509 0.83 CA1 (0.53) CA12CA1CA2CA9CA4
SCHEMBL6540208 0.83 MEN1 (0.73) CA12CA1CA2CA9CA4
SCHEMBL6540565 0.82 LTA4H (0.64) CA12CA1CA2CA9CA4
SCHEMBL6541122 0.82 CA1 (0.68) CA12CA1CA2CA9CA4
SCHEMBL6541026 0.80 CA1 (0.52) CA12CA1CA2CA9CA4
SCHEMBL597987 0.79 CA1 (0.69) CA12CA1CA2CA9CA4
SCHEMBL6798547 0.78 HTR6 (0.56) HTR6ATMNAMPTGAAMAPT

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.