SCHEMBL9200412

SCHEMBL9200412

CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H](N)[C@H](O)C(C)(C)O2

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 14/20 0.45
KCNQ1 P51787 14/20 0.45
ABCC9 O60706 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
KCND3 Q9UK17 1/20 0.41
TSHR P16473 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
KCNA5 P22460 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
SCHEMBL9200400 1.00 KCNE1 (0.45) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL9200392 1.00 KCNE1 (0.45) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL7836596 0.86 ABCC9 (0.56) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL7836593 0.86 ABCC9 (0.56) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL9200759 0.85 KCNE1 (0.45) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL9200749 0.85 KCNE1 (0.45) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL9200746 0.85 KCNE1 (0.45) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL8003991 0.85 KCNE1 (0.41) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL9194043 0.82 KCNE1 (0.43) KCNE1KCNQ1ABCC9MEN1KMT2A
SCHEMBL9194055 0.82 KCNE1 (0.43) KCNE1KCNQ1ABCC9MEN1KMT2A

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
EP-0389861-B1 Benzopyran derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1995-08-23 EP disclosed
US-5104890-A Potassium channel activtors; vasodilators FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-04-14 US disclosed
EP-0389861-A1 Benzopyran derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-10-03 EP disclosed