SCHEMBL7095841

SCHEMBL7095841

O=C1CCC2=C1C(c1ccc(F)c(C(F)(F)F)c1)C1=C(CCOC1=O)N2

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 20/20 0.73
KCNJ11 Q14654 20/20 0.73
ABCC8 Q09428 18/20 0.73
KCNJ8 Q15842 18/20 0.73

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
SCHEMBL7853155 0.94 ABCC9 (0.74) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7094768 0.91 ABCC9 (0.73) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7095392 0.91 ABCC9 (0.73) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7098675 0.85 ABCC9 (0.74) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7098310 0.85 ABCC9 (0.74) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7096460 0.85 ABCC9 (0.74) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7005308 0.84 ABCC9 (1.00) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7095780 0.83 ABCC9 (0.69) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7852788 0.81 ABCC9 (0.72) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7018720 0.81 ABCC9 (0.53) ABCC9KCNJ11ABCC8KCNJ8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1278746-A2 DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE Abbott Laboratories (US) 2003-01-29 EP claimed
WO-2001083480-A2 DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE ABBOTT LABORATORIES (US) 2001-11-08 WO claimed
EP-1131322-A2 DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE ABBOTT LABORATORIES (US) 2001-09-12 EP claimed
WO-2000024741-A2 DIHYDROPYRIDINE COMPOUNDS AND THEIR USE AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2000-05-04 WO claimed
EP-1278746-A2 DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE Abbott Laboratories (US) 2003-01-29 EP disclosed
WO-2001083480-A2 DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE ABBOTT LABORATORIES (US) 2001-11-08 WO disclosed
EP-1131322-A2 DIHYDROPYRIDINE COMPOUNDS AND METHODS OF USE ABBOTT LABORATORIES (US) 2001-09-12 EP disclosed
WO-2000024741-A2 DIHYDROPYRIDINE COMPOUNDS AND THEIR USE AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2000-05-04 WO disclosed