SCHEMBL8903198

SCHEMBL8903198

C[C@]12[C@@H](O)C[C@@]3(C)[C@@H](CC[C@]3(O)C(=O)CO)[C@@H]1CCC1=CC(=O)CC[C@@]12C

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 6/20 0.79
ALDH1A1 P00352 2/20 0.71
MAPK1 P28482 1/20 0.71
CYP2C19 P33261 4/20 0.63
SERPINA6 P08185 4/20 0.62
HIF1A Q16665 5/20 0.61
PGR P06401 3/20 0.61
HRH1 P35367 1/20 0.61
HSD17B10 Q99714 8/20 0.60
SHBG P04278 3/20 0.60
CYP3A4 P08684 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
KMT2A Q03164 2/20 0.60
NR3C2 P08235 1/20 0.60
MAPT P10636 1/20 0.60
NFKB1 P19838 1/20 0.60
LMNA P02545 2/20 0.57
PMP22 Q01453 2/20 0.57
TSHR P16473 2/20 0.57
BLM P54132 1/20 0.57

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
SCHEMBL607348 0.90 NR3C1 (0.79) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
Fludrocortisone SCHEMBL10598529 0.88 NR3C1 (1.00) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
SCHEMBL10429009 0.88 NR3C1 (0.76) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
Fludrocortisone SCHEMBL4545 0.88 NR3C1 (1.00) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
Fludrocortisone SCHEMBL13026141 0.88 NR3C1 (1.00) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
Fludrocortisone SCHEMBL23975175 0.88 NR3C1 (1.00) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
SCHEMBL10429011 0.88 NR3C1 (0.76) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
Fludrocortisone SCHEMBL4323075 0.88 NR3C1 (1.00) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
Fludrocortisone SCHEMBL19327146 0.88 NR3C1 (1.00) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6
SCHEMBL11236450 0.88 NR3C1 (0.76) NR3C1ALDH1A1MAPK1CYP2C19SERPINA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107501373-B A kind of preparation method of danabol 湖南科瑞生物制药股份有限公司 2019-11-05 CN claimed
CN-107501373-A A kind of preparation method of danabol 湖南科瑞生物制药股份有限公司 2017-12-22 CN claimed
US-5667783-A Method of treating HIV positive subjects Alen, Constantine (US) 1997-09-16 US claimed
US-11965199-B2 21-hydroxylation of steroids SANOFI (FR) 2024-04-23 US disclosed
US-11608514-B2 21-hydroxylation of steroids EUROAPI 2023-03-21 US disclosed
US-20220228189-A1 21-Hydroxylation of Steroids EUROAPI (FR) 2022-07-21 US disclosed
CN-114540453-A 21-hydroxylation of steroids 赛诺菲 2022-05-27 CN disclosed
EP-3957739-A1 21-HYDROXYLATION OF STEROIDS SANOFI (FR) 2022-02-23 EP disclosed
CN-108138215-B 21-hydroxylation of steroids 赛诺菲 2022-01-25 CN disclosed
EP-3212800-B1 21-HYDROXYLATION OF STEROIDS SANOFI SA (FR) 2021-09-15 EP disclosed
CN-111065409-A STREP-TAG specific binding protein and application thereof 弗雷德哈钦森癌症研究中心 2020-04-24 CN disclosed
CN-107501373-A A kind of preparation method of danabol 湖南科瑞生物制药股份有限公司 2017-12-22 CN disclosed
US-20170321241-A1 21-Hydroxylation of Steroids EUROAPI FRANCE (FR) 2017-11-09 US disclosed
EP-3212800-A1 21-HYDROXYLATION OF STEROIDS SANOFI (FR) 2017-09-06 EP disclosed
US-9638703-B2 Quantification of glucocorticoids in fish scales as biomarkers for chronic stress UNIVERSITEIT GENT (BE) 2017-05-02 US disclosed
CN-106456846-A Chitosan and polyethylene glycol copolymers and methods and devices for sealing vascular perforations using the same 通合公司 2017-02-22 CN disclosed
WO-2016066738-A1 21-HYDROXYLATION OF STEROIDS SANOFI (FR) 2016-05-06 WO disclosed
EP-3015550-A1 21-Hydroxylation of steroids SANOFI (FR) 2016-05-04 EP disclosed
CN-101730538-B Imaging and therapy of virus-associated tumors UNIV JOHNS HOPKINS 2015-04-29 CN disclosed
CN-101730538-A Imaging and therapy with viral related neoplasms UNIV JOHNS HOPKINS 2010-06-09 CN disclosed