SCHEMBL9263304

SCHEMBL9263304

CC(=O)Oc1ccc2c(c1)OC=C(C(=O)N1CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC1)O2

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.47
ALDH1A1 P00352 1/20 0.40
CACNA2D1 P54289 1/20 0.40
CACNA1B Q00975 1/20 0.40
CACNB1 Q02641 1/20 0.40
CACNA1C Q13936 1/20 0.40
DPP4 P27487 1/20 0.39
FAAH O00519 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
ACHE P22303 1/20 0.37
DPP8 Q6V1X1 2/20 0.37
DPP7 Q9UHL4 1/20 0.37
FAP Q12884 1/20 0.37
DPP9 Q86TI2 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL9261790 0.91 MGLL (0.46) MGLLCACNA2D1CACNA1BCACNB1CACNA1C
SCHEMBL9256320 0.91 MGLL (0.45) MGLLALDH1A1CACNA2D1CACNA1BCACNB1
SCHEMBL9264047 0.91 MGLL (0.44) MGLLALDH1A1CACNA2D1CACNA1BCACNB1
SCHEMBL9259528 0.88 MGLL (0.45) MGLLALDH1A1CACNA2D1CACNA1BCACNB1
SCHEMBL9257887 0.87 MGLL (0.41) MGLLALDH1A1CACNA2D1CACNA1BCACNB1
SCHEMBL9254614 0.86 MGLL (0.43) MGLLALDH1A1CACNA2D1CACNA1BCACNB1
SCHEMBL9251722 0.84 KMT2A (0.48) MGLLALDH1A1FAAHKMT2A
SCHEMBL9254998 0.83 ALDH1A1 (0.51) MGLLALDH1A1CACNA2D1CACNA1BCACNB1
SCHEMBL9261257 0.83 ALDH1A1 (0.40) MGLLALDH1A1CACNA2D1CACNA1BCACNB1
SCHEMBL9262507 0.82 KMT2A (0.48) MGLLALDH1A1KMT2A

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
US-5439909-A 2-Substituted with amide or thioamide group; antioxidant for lipoproteins, antilipemic agents, anticholesterol agents ADIR ET COMPAGNIE (FR) 1995-08-08 US disclosed
US-5420132-A Antilipemic agents ADIR ET COMPAGNIE (FR) 1995-05-30 US disclosed
EP-0624582-A1 Substituted benzodioxine, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-11-17 EP disclosed