SCHEMBL5576289

SCHEMBL5576289

COc1ccc(-c2cccs2)cc1C=CC(=O)c1ccc(OCc2ccccn2)c(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 20/20 1.00

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
SCHEMBL14454081 1.00 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5575958 0.89 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5575961 0.89 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5574946 0.87 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5574947 0.87 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5575695 0.86 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5575701 0.86 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5576253 0.85 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5576256 0.85 TNFRSF1A (1.00) TNFRSF1A
SCHEMBL5576287 0.83 TNFRSF1A (0.71) TNFRSF1A

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
US-7247714-B2 Protection against oxidative stress and inflammation by a cytoprotective response element ATHEROGENICS, INC. (US) 2007-07-24 US disclosed