SCHEMBL8177993

SCHEMBL8177993

C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@@H](O)[C@@H]2OC(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.65
LMNA P02545 6/20 0.65
ESR2 Q92731 4/20 0.65
NR3C1 P04150 3/20 0.65
SHBG P04278 3/20 0.65
SLC6A4 P31645 3/20 0.65
HIF1A Q16665 3/20 0.65
CYP2C9 P11712 2/20 0.65
CYP2C19 P33261 2/20 0.65
PGR P06401 2/20 0.65
SERPINA6 P08185 2/20 0.65
AR P10275 2/20 0.65
SNCA P37840 2/20 0.65
SLC6A3 Q01959 2/20 0.65
PTGS1 P23219 1/20 0.65
OR51E2 Q9H255 1/20 0.65
UGT1A10 Q9HAW8 1/20 0.65
KDM4E B2RXH2 1/20 0.63
ABCC1 P33527 1/20 0.63
HSD17B1 P14061 3/20 0.58

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
SCHEMBL10360627 0.90 ESR1 (0.73) ESR1LMNAESR2NR3C1SHBG
SCHEMBL347435 0.89 ESR1 (0.66) ESR1LMNAESR2NR3C1SHBG
SCHEMBL6130903 0.88 CA2 (0.58) ESR1LMNAESR2NR3C1SHBG
SCHEMBL6130919 0.88 CA2 (0.60) ESR1LMNAESR2NR3C1SHBG
SCHEMBL21540456 0.86 ESR1 (0.69) ESR1LMNAESR2NR3C1SHBG
SCHEMBL8208515 0.85 ESR1 (0.71) ESR1LMNAESR2NR3C1SHBG
SCHEMBL5527384 0.85 KMT2A (0.71) ESR1LMNAESR2NR3C1SHBG
Estriol SCHEMBL8178008 0.85 ESR1 (0.80) ESR1LMNAESR2NR3C1SHBG
SCHEMBL12180360 0.84 LMNA (0.76) ESR1LMNANR3C1SHBGSLC6A4
SCHEMBL26659960 0.84 LMNA (0.76) ESR1LMNANR3C1SHBGSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111433577-B Temperature detection label and article management device using same 株式会社日立制作所 2021-09-21 CN disclosed
CN-110603431-B Temperature detection material, temperature detection ink using same, temperature indicator, and article management system 株式会社日立产机系统 2021-06-15 CN disclosed
EP-2484383-B1 METHOD FOR IMPROVING THE AQUEOUS SOLUBILITY OF POORLY-SOLUBLE SUBSTANCES SANGI KK (JP) 2021-04-28 EP disclosed
EP-3054940-B1 COMPOSITIONS AND METHODS FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS MOCHIDA PHARM CO LTD (JP) 2020-09-23 EP disclosed
CN-110603431-A Temperature detection material, temperature detection ink using same, temperature indicator, and article management system 株式会社日立产机系统 2019-12-20 CN disclosed
EP-3054940-A1 COMPOSITIONS AND METHODS FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS Mochida Pharmaceutical Co., Ltd. (JP) 2016-08-17 EP disclosed
US-20160213639-A1 COMPOSITIONS AND METHODS FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2016-07-28 US disclosed
US-9248103-B2 Method for improving water solubility of slightly soluble substance KABUSHIKI KAISHA SANGI (JP) 2016-02-02 US disclosed
US-9023398-B2 Method for improving the aqueous solubility of poorly-soluble substances KABUSHIKI KAISHA SANGI (JP) 2015-05-05 US disclosed
WO-2015053379-A1 COMPOSITIONS AND METHODS FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-04-16 WO disclosed
US-20120264608-A1 Method for Improving the Aqueous Solubility of Poorly-Soluble Substances KABUSHIKI KAISHA SANGI (JP) 2012-10-18 US disclosed
EP-2484383-A1 METHOD FOR IMPROVING THE AQUEOUS SOLUBILITY OF POORLY-SOLUBLE SUBSTANCES KABUSHIKI KAISHA SANGI (JP) 2012-08-08 EP disclosed
US-6083916-A Pharmaceutical product for application to uterus mucosa TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-07-04 US disclosed
EP-0873751-A2 Pharmaceutical product for application to uterus mucosa TAKEDA CHEMICAL INDUSTRIES, Ltd. (JP) 1998-10-28 EP disclosed
EP-0424954-B1 Pharmaceutical composition for treatment of osteoporosis NIPPON ZOKI PHARMACEUTICAL CO (JP) 1994-04-27 EP disclosed
US-5116828-A Estrogen and thyroid hormone NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1992-05-26 US disclosed
EP-0253901-B1 SUSTAINED-RELEASE PREPARATION TEIJIN LIMITED (JP) 1991-12-27 EP disclosed
EP-0424954-A1 Pharmaceutical composition for treatment of osteoporosis NIPPON ZOKI PHARMACEUTICAL CO. LTD. (JP) 1991-05-02 EP disclosed
US-4990340-A Percutaneous administration without skin irritability TEIJIN LIMITED (JP) 1991-02-05 US disclosed
EP-0253901-A1 SUSTAINED-RELEASE PREPARATION TEIJIN LIMITED (JP) 1988-01-27 EP disclosed