SCHEMBL10071070

SCHEMBL10071070

COc1cc2c(cc1OS(N)(=O)=O)CCC1C2CC[C@@]2(C)C1CC[C@@H]2OS(N)(=O)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
STS P08842 14/20 1.00
CA2 P00918 7/20 1.00
CA9 Q16790 6/20 1.00
CA1 P00915 2/20 0.72
ABCC4 O15439 1/20 0.56
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 2/20 0.56
HSD17B10 Q99714 2/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56
CYP2C19 P33261 1/20 0.56
THPO P40225 1/20 0.56

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
SCHEMBL13318875 1.00 STS (1.00) STSCA2CA9CA1ABCC4
SCHEMBL14513805 1.00 STS (1.00) STSCA2CA9CA1ABCC4
SCHEMBL446846 1.00 STS (1.00) STSCA2CA9CA1ABCC4
SCHEMBL29551370 1.00 STS (1.00) STSCA2CA9CA1ABCC4
SCHEMBL14549386 1.00 STS (1.00) STSCA2CA9CA1ABCC4
SCHEMBL13318877 0.95 STS (0.91) STSCA2CA9CA1ABCC4
SCHEMBL14395445 0.91 STS (0.83) STSCA2CA9CA1ABCC4
SCHEMBL1237204 0.90 STS (0.81) STSCA2CA9CA1CYP1A2
SCHEMBL14070736 0.89 STS (0.80) STSCA2CA9CA1CYP1A2
SCHEMBL4212438 0.89 STS (0.80) STSCA2CA9CA1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2484351-B1 Use of steroid sulfatase inhibitors for the treatment of preterm labor PREGLEM SA (CH) 2016-02-24 EP disclosed
EP-2117530-B1 COMPOSITION COMPRISING 2DG AND STX140 FOR THE TREATMENT OF CANCER STERIX LTD (GB) 2013-01-09 EP disclosed
EP-2484351-A1 Use of steroid sulfatase inhibitors for the treatment of preterm labor PregLem S.A. (CH) 2012-08-08 EP disclosed
EP-2323646-B1 USE OF STEROID SULFATASE INHIBITORS FOR THE TREATMENT OF PRETERM LABOR PREGLEM SA (CH) 2012-02-22 EP disclosed
US-20110118224-A1 USE OF STEROID SULFATASE INHIBITORS FOR THE TREATMENT OF PRETERM LABOR PREGLEM SA (CH) 2011-05-19 US disclosed
US-20110118224-A1 USE OF STEROID SULFATASE INHIBITORS FOR THE TREATMENT OF PRETERM LABOR PREGLEM SA (CH) 2011-05-19 US disclosed
US-7893284-B2 Oestrogen derivatives as inhibitors of steroid sulphatase STERIX LIMITED (GB) 2011-02-22 US disclosed
US-7893284-B2 Oestrogen derivatives as inhibitors of steroid sulphatase STERIX LIMITED (GB) 2011-02-22 US disclosed
US-20100204146-A1 Treatment of Oestrogen Dependant Conditions in Pre-menopausal Women PREGLEM S.A. (CH) 2010-08-12 US disclosed
US-20100204146-A1 Treatment of Oestrogen Dependant Conditions in Pre-menopausal Women PREGLEM S.A. (CH) 2010-08-12 US disclosed
WO-2010013187-A1 USE OF STEROID SULFATASE INHIBITORS FOR THE TREATMENT OF PRETERM LABOR PREGLEM SA (CH) 2010-02-04 WO disclosed
EP-2149371-A1 Use of steroid sulfatase inhibitors for the treatment of preterm labor PregLem S.A. (CH) 2010-02-03 EP disclosed
WO-2009037539-A2 TREATMENT OF OESTROGEN DEPENDANT CONDITIONS IN PRE-MENOPAUSAL WOMEN PREGLEM S.A. (CH) 2009-03-26 WO disclosed
EP-1418921-B1 ANTI-TUMOUR 2-ALKOXYESTRADIOL SULFAMATES STERIX LTD (GB) 2007-10-03 EP disclosed
US-20070225256-A1 COMPOUND STERIX LIMITED (GB) 2007-09-27 US disclosed
US-20070225256-A1 COMPOUND STERIX LIMITED (GB) 2007-09-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100204146-A1 Treatment of Oestrogen Dependant Conditions in Pre-menopausal Women STS, CYP19A1, SHBG STS 1/4885CA2 1674/4885CA9 1766/4885
US-20110118224-A1 USE OF STEROID SULFATASE INHIBITORS FOR THE TREATMENT OF PRETERM LABOR STS, SULT1E1, SULT1A1 STS 1/4885CA2 458/4885CA9 2203/4885
US-20070225256-A1 COMPOUND NR5A1, SRD5A1, SRD5A2 STS 47/4885CA2 1299/4885CA9 191/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.