SCHEMBL6799582

SCHEMBL6799582

NS(=O)(=O)NCc1ccc(OS(N)(=O)=O)cc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
STS P08842 5/20 0.63
CA2 P00918 15/20 0.59
CA9 Q16790 13/20 0.59
CA1 P00915 13/20 0.59
CA12 O43570 5/20 0.59
CA14 Q9ULX7 2/20 0.58
CA7 P43166 1/20 0.58
CA5A P35218 1/20 0.47

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
SCHEMBL6552067 0.81 CA1 (0.70) CA2CA9CA1CA12CA14
SCHEMBL6799239 0.80 STS (0.61) STSCA2CA9CA1CA12
SCHEMBL2501211 0.78 STS (1.00) STSCA2CA9CA1CA12
SCHEMBL7454758 0.76 CA2 (0.58) STSCA2CA9CA1CA12
SCHEMBL16479548 0.75 CA2 (0.66) CA2CA9CA1CA12CA14
SCHEMBL1870820 0.75 CA1 (0.66) CA2CA9CA1CA12CA14
SCHEMBL14380636 0.75 CA2 (0.66) CA2CA9CA1CA12CA14
SCHEMBL14380626 0.75 MEN1 (0.70) CA2CA9CA1CA12CA14
SCHEMBL49549 0.74 CA2 (1.00) CA2CA9CA1CA12CA14
SCHEMBL6800525 0.74 STS (0.53) STSCA2CA9CA1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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