SCHEMBL2889416

SCHEMBL2889416

COc1cc2c(cc1NS(C)(=O)=O)OC(C)(C)C(O)C2NCCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 8/20 0.47
ABCB1 P08183 5/20 0.46
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NR3C1 P04150 1/20 0.40
KCNE1 P15382 1/20 0.38
KCNQ1 P51787 1/20 0.38
CYP19A1 P11511 1/20 0.38
IDO1 P14902 1/20 0.37

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
SCHEMBL2889419 1.00 KCNA5 (0.47) KCNA5ABCB1ALDH1A1MEN1KMT2A
SCHEMBL2887648 0.91 KCNA5 (0.50) KCNA5ABCB1KCNE1KCNQ1IDO1
SCHEMBL2884000 0.88 KCNA5 (0.48) KCNA5ABCB1KCNE1KCNQ1IDO1
SCHEMBL2883998 0.88 KCNA5 (0.48) KCNA5ABCB1KCNE1KCNQ1IDO1
SCHEMBL2893285 0.88 ABCB1 (0.46) KCNA5ABCB1ALDH1A1
SCHEMBL2884031 0.88 ABCB1 (0.46) KCNA5ABCB1ALDH1A1
SCHEMBL2884035 0.88 ABCB1 (0.46) KCNA5ABCB1ALDH1A1
SCHEMBL5989846 0.87 KCNA5 (0.47) KCNA5ABCB1KCNE1KCNQ1IDO1
SCHEMBL2883962 0.87 KCNA5 (0.47) KCNA5ABCB1KCNE1KCNQ1IDO1
Hydrochloric Acid SCHEMBL2896253 0.87 ABCB1 (0.45) KCNA5ABCB1ALDH1A1

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 69/4885ABCB1 978/4885ALDH1A1 2971/4885

“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.