SCHEMBL4667170

SCHEMBL4667170

NS(=O)(=O)Nc1ccccc1-c1ccc(OS(N)(=O)=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.58
CA9 Q16790 13/20 0.58
CA1 P00915 12/20 0.58
CA12 O43570 3/20 0.58
STAT3 P40763 2/20 0.46
STS P08842 2/20 0.44
KIF11 P52732 1/20 0.44
ALOX5AP P20292 1/20 0.43
FEN1 P39748 1/20 0.43

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
SCHEMBL4665448 0.88 KDM1A (0.56) CA2CA9CA1CA12STAT3
SCHEMBL4665426 0.76 CA2 (0.62) CA2CA9CA1CA12STS
SCHEMBL4665451 0.76 CA2 (0.62) CA2CA9CA1CA12STS
SCHEMBL4668685 0.76 CA2 (0.62) CA2CA9CA1CA12STS
SCHEMBL4666139 0.75 CA2 (0.61) CA2CA9CA1CA12KIF11
SCHEMBL7263619 0.74 CA2 (1.00) CA2CA9CA1CA12STS
SCHEMBL4668710 0.73 CA2 (0.62) CA2CA9CA1CA12
SCHEMBL4777296 0.72 KIF11 (0.59) CA2CA9CA1CA12STS
SCHEMBL4667728 0.72 STS (0.68) CA2CA9CA1CA12STS
SCHEMBL4667326 0.71 ALDH1A1 (0.57) CA2CA9CA1CA12STS

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1193250-B1 PHENYL SULFAMATE DERIVATIVES TEIKOKU HORMONE MFG CO LTD (JP) 2008-06-04 EP disclosed
US-6762205-B1 STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION TEIKOKU HORMONE MFG. CO., LTD. (JP) 2004-07-13 US disclosed
EP-1193250-A1 PHENYL SULFAMATE DERIVATIVES Teikoku Hormone Mfg. Co., Ltd. (JP) 2002-04-03 EP disclosed