SCHEMBL7820140

SCHEMBL7820140

CN(c1ccc(F)cc1)S(=O)(=O)c1ccc2c(c1)[C@H](N1CCCCC1=O)[C@@H](O)C(C)(C)O2

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ABCC9 O60706 9/20 0.53
▸ ABCC8 Q09428 2/20 0.53
▸ KCNJ11 Q14654 2/20 0.53
▸ KCNJ8 Q15842 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CYP2D6 P10635 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ KCNE1 P15382 3/20 0.39
▸ KCNQ1 P51787 3/20 0.39
▸ TP53 P04637 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HSD17B10 Q99714 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
SCHEMBL7820142 1.00 ABCC9 (0.53) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7820143 1.00 ABCC9 (0.53) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7821027 0.91 ABCC9 (0.55) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7823229 0.91 ABCC9 (0.55) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7821028 0.91 ABCC9 (0.55) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7822793 0.91 ABCC9 (0.51) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7822791 0.91 ABCC9 (0.51) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7822798 0.91 ABCC9 (0.51) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7823905 0.90 ABCC9 (0.51) ABCC9ABCC8KCNJ11KCNJ8LMNA
SCHEMBL7823899 0.90 ABCC9 (0.51) ABCC9ABCC8KCNJ11KCNJ8LMNA

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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