SCHEMBL7918664

SCHEMBL7918664

CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2F)c(=O)n([C@@H](C)CC[C@H](CC)OCC(C)(C)O)c2nc(C)nn12

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC33A1 O00400 20/20 0.68

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
SCHEMBL7913785 0.86 SLC33A1 (0.72) SLC33A1
SCHEMBL7907504 0.86 SLC33A1 (0.68) SLC33A1
SCHEMBL1370152 0.85 SLC33A1 (0.69) SLC33A1
SCHEMBL7914344 0.85 SLC33A1 (0.75) SLC33A1
SCHEMBL7913930 0.83 SLC33A1 (0.75) SLC33A1
SCHEMBL1371407 0.81 SLC33A1 (1.00) SLC33A1
SCHEMBL1371406 0.81 SLC33A1 (1.00) SLC33A1
SCHEMBL1372784 0.81 SLC33A1 (1.00) SLC33A1
SCHEMBL1371109 0.81 SLC33A1 (0.76) SLC33A1
SCHEMBL15469450 0.81 SLC33A1 (0.81) SLC33A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010087515-A1 FUSED RING COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-05 WO disclosed