SCHEMBL6539474

SCHEMBL6539474

CCOC(=O)c1ccc(S(=O)(=O)c2ccc(CCNCc3ccccc3)cc2)cc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
CA1 P00915 4/20 0.49
CA2 P00918 4/20 0.49
CA12 O43570 3/20 0.49
CA9 Q16790 3/20 0.49
CA4 P22748 1/20 0.49
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ATM Q13315 1/20 0.46
SFRP1 Q8N474 1/20 0.46
GAA P10253 2/20 0.45
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
ABL1 P00519 1/20 0.43
MAPK1 P28482 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
SCHEMBL6679701 0.91 CA1 (0.51) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6540016 0.90 CA1 (0.47) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6679489 0.89 CA1 (0.51) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6541100 0.88 SMN1; SMN2 (0.68) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6540180 0.85 SMN1; SMN2 (0.55) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6678367 0.85 SMN1; SMN2 (0.46) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6540593 0.84 SMN1; SMN2 (0.59) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6679837 0.83 KMT2A (0.43) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6680446 0.83 KDM4E (0.48) SMN1; SMN2CA1CA2CA12CA9
SCHEMBL6676306 0.83 OPRM1 (0.49) SMN1; SMN2CA1CA2CA12CA9

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 SMN1; SMN2 2146/4885CA1 4181/4885CA2 2242/4885

“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.