SCHEMBL4454425

SCHEMBL4454425

Nc1cccc2c(S(=O)(=O)NCc3ccc([N+](=O)[O-])cc3)cccc12

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 15/20 0.70
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CYP19A1 P11511 1/20 0.53
LMNA P02545 1/20 0.52

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 SCHEMBL4443004 0.99 NSD2 (0.71) NSD2CA1CA2CYP19A1LMNA
SCHEMBL4445436 0.88 NSD2 (0.67) NSD2CYP19A1
Hydrochloric Acid SCHEMBL4448157 0.87 NSD2 (0.67) NSD2CYP19A1
SCHEMBL4483894 0.85 CA2 (0.55) NSD2CA1CA2CYP19A1LMNA
SCHEMBL4450802 0.84 NSD2 (0.82) NSD2CA1CA2
SCHEMBL4450751 0.83 NSD2 (0.76) NSD2CA1CA2
SCHEMBL4445013 0.83 NSD2 (1.00) NSD2CA1CA2LMNA
Hydrochloric Acid SCHEMBL4445018 0.83 NSD2 (0.82) NSD2CA1CA2
SCHEMBL4441197 0.83 NSD2 (1.00) NSD2
Hydrochloric Acid SCHEMBL4454755 0.82 NSD2 (0.76) NSD2CA1CA2

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