SCHEMBL6799239

SCHEMBL6799239

NS(=O)(=O)Oc1ccc(CNc2ccc(OS(N)(=O)=O)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
STS P08842 2/20 0.61
CA2 P00918 17/20 0.60
CA1 P00915 15/20 0.60
CA9 Q16790 14/20 0.60
CA12 O43570 7/20 0.60

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
SCHEMBL6801523 0.92 CA2 (0.66) STSCA2CA1CA9CA12
SCHEMBL7454758 0.92 CA2 (0.58) STSCA2CA1CA9CA12
SCHEMBL6797084 0.88 CA1 (0.67) STSCA2CA1CA9CA12
SCHEMBL6799583 0.87 CA1 (0.68) STSCA2CA1CA9CA12
SCHEMBL6799582 0.80 STS (0.63) STSCA2CA1CA9CA12
SCHEMBL2501211 0.77 STS (1.00) STSCA2CA1CA9CA12
SCHEMBL32665122 0.76 CA1 (0.47) CA2CA1CA9CA12
SCHEMBL6794490 0.74 KDM4E (0.60) STSCA2CA1CA9CA12
SCHEMBL6800525 0.72 STS (0.53) STSCA2CA1CA9CA12
SCHEMBL1844199 0.71 MAPT (0.82) CA2CA1CA9CA12

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