SCHEMBL3370529

SCHEMBL3370529

CNS(=O)(=O)Oc1cc2c(c(O)c1O)C1CC[C@]3(C)CCCC3C1CC2

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
STS P08842 12/20 0.50
SHBG P04278 1/20 0.48
HSD17B1 P14061 2/20 0.37
ESR1 P03372 1/20 0.37
CA2 P00918 5/20 0.36
CA9 Q16790 4/20 0.36
CA1 P00915 1/20 0.36
ABCC4 O15439 1/20 0.35
CYP19A1 P11511 3/20 0.35

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
SCHEMBL6869789 0.88 STS (0.64) STSSHBGCA2CA9
SCHEMBL3374308 0.86 STS (0.52) STSSHBGHSD17B1ESR1CA2
SCHEMBL8216010 0.86 STS (0.52) STSSHBGHSD17B1ESR1CA2
SCHEMBL3373874 0.84 STS (0.48) STSSHBGHSD17B1ESR1CA2
SCHEMBL3371048 0.82 STS (0.46) STSSHBGHSD17B1ESR1CA2
SCHEMBL3371053 0.82 STS (0.46) STSSHBGHSD17B1ESR1CA2
SCHEMBL7101544 0.80 SHBG (0.52) STSSHBGHSD17B1ESR1CA2
SCHEMBL8571107 0.79 SHBG (0.60) STSSHBGHSD17B1ESR1CYP19A1
SCHEMBL6130909 0.77 STS (0.48) STSSHBGESR1CA2CA9
SCHEMBL8088835 0.75 SHBG (0.54) STSSHBGHSD17B1ESR1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1284273-B1 Estra-1,3,5(10)-trien-3-sulfamates a process for their production and pharmaceutical compositions containing them STERIX LTD (GB) 2010-09-29 EP claimed
EP-1284273-A2 Estra-1,3,5(10)-trien-3-sulfamates a process for their production and pharmaceutical compositions containing them JENAPHARM GmbH (DE) 2003-02-19 EP claimed
EP-1284273-B1 Estra-1,3,5(10)-trien-3-sulfamates a process for their production and pharmaceutical compositions containing them STERIX LTD (GB) 2010-09-29 EP disclosed
EP-1284273-A2 Estra-1,3,5(10)-trien-3-sulfamates a process for their production and pharmaceutical compositions containing them JENAPHARM GmbH (DE) 2003-02-19 EP disclosed