SCHEMBL2842927

SCHEMBL2842927

CCCc1nc(C)n(-c2ccc(OC3CCC3)cc2)c(=O)c1Cc1ccc(-c2ccccc2)c(-c2noc(=O)[nH]2)c1

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC33A1 O00400 20/20 0.49

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
SCHEMBL4306427 0.97 SLC33A1 (0.50) SLC33A1
SCHEMBL1888914 0.93 SLC33A1 (0.56) SLC33A1
Hydrochloric Acid SCHEMBL1885834 0.92 SLC33A1 (0.55) SLC33A1
SCHEMBL1893770 0.92 SLC33A1 (0.55) SLC33A1
Bromide SCHEMBL1893449 0.92 SLC33A1 (0.55) SLC33A1
SCHEMBL1893670 0.92 SLC33A1 (0.55) SLC33A1
SCHEMBL1886719 0.92 SLC33A1 (0.56) SLC33A1
SCHEMBL1896366 0.92 SLC33A1 (0.57) SLC33A1
SCHEMBL1889422 0.91 SLC33A1 (0.58) SLC33A1
Hydrochloric Acid SCHEMBL1890378 0.90 SLC33A1 (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2256115-A1 Heteromonocyclic compound and use thereof Takeda Pharmaceutical Company Limited (JP) 2010-12-01 EP disclosed
WO-2009133970-A1 CRYSTALLINE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-05 WO disclosed