SCHEMBL3507486

SCHEMBL3507486

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(O)CCC(=O)O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 6/20 0.67
NR3C1 P04150 4/20 0.67
PGR P06401 3/20 0.67
ALDH1A1 P00352 3/20 0.67
ADRA1A P35348 1/20 0.67
HTR2B P41595 1/20 0.67
LMNA P02545 6/20 0.65
SMN1; SMN2 Q16637 6/20 0.65
SERPINA6 P08185 5/20 0.65
BLM P54132 4/20 0.65
CYP2C19 P33261 3/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
ADORA3 P0DMS8 2/20 0.65
MAPT P10636 2/20 0.65
SLC6A3 Q01959 2/20 0.65
MAPK3 P27361 1/20 0.65
HSD17B10 Q99714 4/20 0.64
TSHR P16473 3/20 0.64
HIF1A Q16665 3/20 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
SCHEMBL3507483 1.00 SHBG (0.67) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL10959929 0.99 SHBG (0.65) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL10959915 0.99 SHBG (0.65) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL10961047 0.90 SHBG (0.64) SHBGNR3C1PGRALDH1A1ADRA1A
Potassium Ion SCHEMBL10959922 0.90 TDP1 (0.67) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL10961041 0.90 SHBG (0.64) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL7497323 0.89 SHBG (0.69) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL7497316 0.89 SHBG (0.69) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL9848864 0.89 SHBG (0.69) SHBGNR3C1PGRALDH1A1ADRA1A
Topterone SCHEMBL8846971 0.88 SHBG (0.71) SHBGNR3C1PGRALDH1A1ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0981327-B1 INTRAVAGINAL DRUG DELIVERY DEVICES FOR THE ADMINISTRATION OF TESTOSTERONE AND TESTOSTERONE PRECURSORS GALEN CHEMICALS LTD (IE) 2002-11-06 EP claimed
US-6416780-B1 Intravaginal drug delivery devices for the administration of testosterone and testosterone precursors GALEN (CHEMICALS) LIMITED (IE) 2002-07-09 US claimed
EP-0981327-A2 INTRAVAGINAL DRUG DELIVERY DEVICES FOR THE ADMINISTRATION OF TESTOSTERONE AND TESTOSTERONE PRECURSORS GALEN (CHEMICALS) LIMITED (IE) 2000-03-01 EP claimed
WO-1998050016-A2 INTRAVAGINAL DRUG DELIVERY DEVICES FOR THE ADMINISTRATION OF TESTOSTERONE AND TESTOSTERONE PRECURSORS GALEN (CHEMICALS) LIMITED (IE) 1998-11-12 WO claimed
US-4267106-A New process for the preparation 17β-hydroxy-3-oxo-17α-pregnene and pregnadiene-21-carboxylic acid γ-lactones GIST BROCADES N.V. (NL) 1981-05-12 US claimed
US-4057542-A Process for the preparation of 17β-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone G. D. SEARLE & CO. (US) 1977-11-08 US claimed
US-4057543-A Process for the preparation of 17β-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone G. D. SEARLE & CO. (US) 1977-11-08 US claimed
US-11918770-B2 Implants for localized drug delivery and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-03-05 US disclosed
US-20220184362-A1 Implants for Localized Drug Delivery and Methods of Use Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-06-16 US disclosed
US-11324935-B2 Implants for localized drug delivery and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-05-10 US disclosed
US-10912933-B2 Implants for localized drug delivery and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-02-09 US disclosed
CN-111214701-A Implants for localized drug delivery and methods of use thereof 加利福尼亚大学董事会 2020-06-02 CN disclosed
CN-106573133-B Implants for localized drug delivery and methods of use thereof 加利福尼亚大学董事会 2020-03-03 CN disclosed
US-4150127-A Novel steroid compounds having an oxygen function in the 19-position CIBA-GEIGY CORPORATION (US) 1979-04-17 US disclosed
US-4057542-A Process for the preparation of 17β-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone G. D. SEARLE & CO. (US) 1977-11-08 US disclosed
US-4057543-A Process for the preparation of 17β-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone G. D. SEARLE & CO. (US) 1977-11-08 US disclosed
US-4057542-A Process for the preparation of 17β-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone G. D. SEARLE & CO. (US) 1977-11-08 US disclosed
US-4057543-A Process for the preparation of 17β-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone G. D. SEARLE & CO. (US) 1977-11-08 US disclosed
US-4057542-A Process for the preparation of 17β-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone G. D. SEARLE & CO. (US) 1977-11-08 US disclosed
US-4057543-A Process for the preparation of 17β-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone G. D. SEARLE & CO. (US) 1977-11-08 US disclosed