SCHEMBL4449327

SCHEMBL4449327

Nc1cccc2c(S(=O)(=O)NCc3ccc(C(=O)O)cc3)cccc12

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 15/20 0.76
FABP4 P15090 2/20 0.62
CCR8 P51685 1/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50

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 SCHEMBL4443333 0.99 NSD2 (0.76) NSD2FABP4CCR8
SCHEMBL4441197 0.86 NSD2 (1.00) NSD2
SCHEMBL4450802 0.85 NSD2 (0.82) NSD2CA12CA9
SCHEMBL4444949 0.84 NSD2 (0.84) NSD2
SCHEMBL1684841 0.84 TSHR (0.65) NSD2FABP4CCR8CA12CA9
SCHEMBL4445013 0.84 NSD2 (1.00) NSD2CA9
Hydrochloric Acid SCHEMBL4445018 0.84 NSD2 (0.82) NSD2CA12CA9
Hydrochloric Acid SCHEMBL4445112 0.83 NSD2 (0.85) NSD2
SCHEMBL4454417 0.83 NSD2 (0.78) NSD2
SCHEMBL4443335 0.83 NSD2 (0.78) NSD2

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