SCHEMBL4454428

SCHEMBL4454428

COc1cc(CNS(=O)(=O)c2cccc3c(N)cccc23)cc(OC)c1OC

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 16/20 0.69
FABP4 P15090 2/20 0.50
ALDH1A1 P00352 1/20 0.44

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
Hydrochloric Acid SCHEMBL4443352 0.99 NSD2 (0.69) NSD2FABP4ALDH1A1
SCHEMBL4454443 0.88 NSD2 (0.72) NSD2FABP4
Hydrochloric Acid SCHEMBL4447200 0.87 NSD2 (0.73) NSD2FABP4
SCHEMBL4450808 0.85 NSD2 (0.80) NSD2FABP4ALDH1A1
SCHEMBL4449055 0.85 NSD2 (0.68) NSD2FABP4
Hydrochloric Acid SCHEMBL4444622 0.84 NSD2 (0.80) NSD2FABP4ALDH1A1
Hydrochloric Acid SCHEMBL4445423 0.84 NSD2 (0.69) NSD2FABP4
SCHEMBL4446873 0.83 NSD2 (0.62) NSD2
Hydrochloric Acid SCHEMBL4448811 0.82 NSD2 (0.63) NSD2
SCHEMBL4445024 0.82 NSD2 (0.78) NSD2ALDH1A1

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-7547716-B2 Sulfonamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-06-16 US claimed