SCHEMBL7914729

SCHEMBL7914729

C=C(C)Cn1c(=O)c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(CCC)n2nc(C)nc12

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC33A1 O00400 20/20 0.78

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
SCHEMBL1370280 0.93 SLC33A1 (0.80) SLC33A1
SCHEMBL1372903 0.90 SLC33A1 (0.81) SLC33A1
SCHEMBL1371164 0.89 SLC33A1 (0.75) SLC33A1
SCHEMBL1371048 0.89 SLC33A1 (0.75) SLC33A1
SCHEMBL1371047 0.89 SLC33A1 (0.75) SLC33A1
SCHEMBL1371259 0.89 SLC33A1 (0.79) SLC33A1
SCHEMBL1370376 0.88 SLC33A1 (0.78) SLC33A1
SCHEMBL1372893 0.88 SLC33A1 (1.00) SLC33A1
SCHEMBL1370928 0.88 SLC33A1 (0.73) SLC33A1
SCHEMBL1370947 0.88 SLC33A1 (0.73) 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