SCHEMBL7818963

SCHEMBL7818963

CN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)[C@@H](n1ccccc1=O)[C@H](O)C(C)(C)O2

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCC9 O60706 10/20 0.45
▸ ATM Q13315 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ KCNA5 P22460 1/20 0.41
▸ POLB P06746 1/20 0.39
▸ HTR2C P28335 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ KCNE1 P15382 2/20 0.37
▸ KCNQ1 P51787 2/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA9 Q16790 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
SCHEMBL7818956 1.00 ABCC9 (0.45) ABCC9ATML3MBTL1KCNA5POLB
SCHEMBL7818959 1.00 ABCC9 (0.45) ABCC9ATML3MBTL1KCNA5POLB
SCHEMBL7822051 1.00 ABCC9 (0.45) ABCC9ATML3MBTL1KCNA5POLB
SCHEMBL9869960 0.85 ABCC9 (0.59) ABCC9KCNA5
SCHEMBL9869955 0.85 ABCC9 (0.59) ABCC9KCNA5
SCHEMBL9869951 0.85 ABCC9 (0.59) ABCC9KCNA5
SCHEMBL7823229 0.81 ABCC9 (0.55) ABCC9ATML3MBTL1KCNA5POLB
SCHEMBL7821027 0.81 ABCC9 (0.55) ABCC9ATML3MBTL1KCNA5POLB
SCHEMBL7821028 0.81 ABCC9 (0.55) ABCC9ATML3MBTL1KCNA5POLB
SCHEMBL9440640 0.81 ABCC9 (0.44) ABCC9KCNA5

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-0828733-B1 BENZOPYRANS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 2001-09-05 — — EP claimed
EP-0828733-B1 BENZOPYRANS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 2001-09-05 — — EP disclosed
US-5905156-A POTASSIUM CHANNEL ACTIVATORS AND BRONCHODILATORS NOVARTIS AG (CH) 1999-05-18 — — US disclosed
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