SCHEMBL6541483

SCHEMBL6541483

O=S(=O)(c1ccc(O)cc1)c1cccc(CCNCc2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.56
CA2 P00918 6/20 0.56
HTR6 P50406 1/20 0.54
CA12 O43570 3/20 0.53
CA9 Q16790 2/20 0.53
CA4 P22748 2/20 0.53
BCHE P06276 4/20 0.50
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
SLC2A1 P11166 1/20 0.47
SFRP1 Q8N474 1/20 0.46
DRD4 P21917 1/20 0.45
MPO P05164 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
NAMPT P43490 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
SCHEMBL6540229 0.92 HTR6 (0.51) CA1CA2HTR6CA12CA9
SCHEMBL6539919 0.91 HTR6 (0.51) CA1CA2HTR6CA12CA9
SCHEMBL6540205 0.89 CA1 (0.69) CA1CA2CA12CA9CA4
SCHEMBL6541401 0.88 CA1 (0.59) CA1CA2HTR6CA12CA9
SCHEMBL6540047 0.84 MEN1 (0.60) CA1CA2HTR6CA12CA9
SCHEMBL6541651 0.81 CA1 (0.63) CA1CA2HTR6CA12CA9
SCHEMBL6541181 0.81 CA1 (0.58) CA1CA2CA12CA9CA4
SCHEMBL6677121 0.81 CA1 (0.50) CA1CA2CA12CA9CA4
SCHEMBL3763353 0.81 HTR6 (0.59) HTR6
SCHEMBL3763771 0.81 HTR6 (0.59) HTR6SFRP1

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 CA1 4181/4885CA2 2242/4885HTR6 522/4885

“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.