Estrone Sulfuric Acid

Estrone Sulfuric Acid

SCHEMBL481201

C1CNCCN1.C[C@]12CCC3c4ccc(OS(=O)(=O)O)cc4CCC3C1CCC2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1

The experimentally established mechanism targets of Estrone Sulfuric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 known ✓ P03372 2/20 0.73
CYP3A4 P08684 3/20 1.00
STS P08842 9/20 0.90
ABCC4 O15439 3/20 0.90
ABCC1 P33527 2/20 0.90
CYP2C9 P11712 1/20 0.90
SLCO1B1 Q9Y6L6 1/20 0.90
KDM4E B2RXH2 2/20 0.73
ESR2 Q92731 2/20 0.73
CA1 P00915 2/20 0.73
CA2 P00918 2/20 0.73
CA9 Q16790 2/20 0.73
CA4 P22748 1/20 0.73
CA6 P23280 1/20 0.73
LMNA P02545 2/20 0.69
MAPT P10636 2/20 0.69
HSD17B1 P14061 2/20 0.69
RECQL P46063 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
ALDH1A1 P00352 1/20 0.64

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
Estrone Sulfuric Acid SCHEMBL4443808 1.00 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL21577 1.00 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL6556684 1.00 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL29366794 1.00 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL7216979 1.00 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL19100296 0.99 CYP3A4 (0.98) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL6931138 0.99 CYP3A4 (0.98) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL14844580 0.99 CYP3A4 (0.98) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL23834600 0.96 CYP3A4 (0.93) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL10772904 0.96 CYP3A4 (0.93) CYP3A4STSABCC4ABCC1CYP2C9

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 1005 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3651746-A1 BIOERODIBLE DRUG DELIVERY IMPLANTS Hera Health Solutions Inc. (US) 2020-05-20 EP claimed
WO-2019014076-A1 BIOERODIBLE DRUG DELIVERY IMPLANTS HERA HEALTH SOLUTIONS INC. (US) 2019-01-17 WO claimed
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II BAUSCH HEALTH IRELAND LIMITED (F/K/A/ VALEANT PHARMACEUTICALS IRELAND LIMITED) (IE) 2015-11-12 US claimed
CN-104825397-A Controlled release delivery device containing organosol coating ISA ODIDI 2015-08-12 CN claimed
CN-101370453-B Compositions and methods for dermal delivery of drugs NUVO RES INC 2013-12-18 CN claimed
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. (US) 2013-08-08 US claimed
US-8288366-B2 Formulation for hair growth CHOCHINOV RONALD H (US) 2012-10-16 US claimed
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. 2011-05-05 US claimed
EP-0930876-B2 USE OF COMPOUNDS THAT PROMOTE OESTROGENIC ACTIVITY FOR ACCLERATING THE HEALING OF SKIN WOUNDS RENOVO LTD (GB) 2010-07-07 EP claimed
US-20100120707-A1 Dosages for menstrual suppression, contraception, and hormone replacement therapy, and methods of administering same PLAYTEX PRODUCTS, LLC 2010-05-13 US claimed
EP-0538443-A4 METHODS AND FORMULATIONS FOR USE IN INHIBITING CONCEPTION AND IN TREATING BENIGN GYNECOLOGICAL DISORDERS 1993-12-08 EP claimed
EP-0559240-A2 Hormone composition containing estrogen and mogestin JENCAP RESEARCH LIMITED (CA) 1993-09-08 EP claimed
US-5211952-A Drug delivery of gonadotropin hormone releasing hormones for time release UNIVERSITY OF SOUTHERN CALIFORNIA (US) 1993-05-18 US claimed
EP-0538443-A1 METHODS AND FORMULATIONS FOR USE IN INHIBITING CONCEPTION AND IN TREATING BENIGN GYNECOLOGICAL DISORDERS. UNIV SOUTHERN CALIFORNIA (US) 1993-04-28 EP claimed
WO-1992018107-A1 METHODS AND FORMULATIONS FOR USE IN INHIBITING CONCEPTION AND IN TREATING BENIGN GYNECOLOGICAL DISORDERS THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 1992-10-29 WO claimed
US-5108995-A HORMONE PREPARATION AND METHOD JENCAP RESEARCH LTD. (CA) 1992-04-28 US claimed
US-4980358-A Method employing gonadal hormones and dopamine agonist intended for combined use in the improvement of lymphocyte function McAdory, George D. (US) 1990-12-25 US claimed
CN-1041528-A HORMONE PREPARATION AND METHOD JENCAP RESEARCH LTD (CA) 1990-04-25 CN claimed
US-4826831-A Method of hormonal treatment for menopausal or post-menopausal disorders involving continuous administration of progestogens and estrogens PRE JAY HOLDINGS LIMITED (CA) 1989-05-02 US claimed
EP-0309263-A2 Hormone composition and use JENCAP RESEARCH LIMITED (CA) 1989-03-29 EP claimed

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-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB ESR1 303/4885CYP3A4 867/4885STS 189/4885
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB ESR1 303/4885CYP3A4 867/4885STS 189/4885
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB ESR1 303/4885CYP3A4 867/4885STS 189/4885

“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.