SCHEMBL2883829

SCHEMBL2883829

COc1cc2c(cc1N(C)S(C)(=O)=O)OC(C)(C)C(O)C2NCCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.44
KCNE1 P15382 3/20 0.42
KCNQ1 P51787 3/20 0.42
ABCB1 P08183 3/20 0.41
ALDH1A1 P00352 1/20 0.39
CYP19A1 P11511 1/20 0.37
HTT P42858 1/20 0.36

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
SCHEMBL2883832 1.00 KCNA5 (0.44) KCNA5KCNE1KCNQ1ABCB1ALDH1A1
SCHEMBL2891793 0.89 ABCB1 (0.45) KCNA5KCNE1KCNQ1ABCB1
SCHEMBL2898637 0.89 ABCB1 (0.45) KCNA5KCNE1KCNQ1ABCB1
SCHEMBL2891797 0.89 ABCB1 (0.45) KCNA5KCNE1KCNQ1ABCB1
SCHEMBL2891258 0.85 KCNE1 (0.39) KCNA5KCNE1KCNQ1CYP19A1
SCHEMBL2889416 0.85 KCNA5 (0.47) KCNA5KCNE1KCNQ1ABCB1ALDH1A1
SCHEMBL2889419 0.85 KCNA5 (0.47) KCNA5KCNE1KCNQ1ABCB1ALDH1A1
SCHEMBL2891256 0.84 ALDH1A1 (0.42) KCNA5KCNE1KCNQ1ALDH1A1HTT
SCHEMBL2891650 0.82 KCNA5 (0.45) KCNA5KCNE1KCNQ1ABCB1
Hydrochloric Acid SCHEMBL2889246 0.81 KCNA5 (0.45) KCNA5KCNE1KCNQ1ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1718629-B1 Benzopyran compounds useful for the treatment of arrhytmia NISSAN CHEMICAL IND LTD (JP) 2012-12-26 EP claimed
US-20070299130-A1 Benzopyran Compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-12-27 US claimed
US-7781483-B2 Benzopyran compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-08-24 US disclosed
US-20070299130-A1 Benzopyran Compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-12-27 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-20070299130-A1 Benzopyran Compound NR0B1, CYP2B6, RYR2 KCNA5 69/4885KCNE1 166/4885KCNQ1 565/4885

“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.