SCHEMBL6805790

SCHEMBL6805790

NS(=O)(=O)Oc1ccc(C(=O)N(c2ccc(OS(N)(=O)=O)cc2)n2cnnc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
STS P08842 9/20 0.51
CYP19A1 P11511 12/20 0.50
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL6799562 0.91 CYP19A1 (0.63) STSCYP19A1CA2CA9
SCHEMBL6799980 0.79 CYP19A1 (0.43) STSCYP19A1CA2CA9
SCHEMBL6799997 0.77 STS (0.62) STSCA2CA9
SCHEMBL6802010 0.75 STS (0.60) STSCA2CA9
SCHEMBL6800782 0.74 STS (0.56) STS
SCHEMBL6802989 0.71 STS (0.64) STSCA2CA9
SCHEMBL2501164 0.69 STS (1.00) STSCA2CA9
SCHEMBL6806168 0.69 STS (0.56) STSCA2CA9
SCHEMBL6801736 0.69 CA1 (0.65) STSCYP19A1CA2CA9
SCHEMBL9451332 0.68 STS (0.74) STSCA2CA9

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