SCHEMBL2596534

SCHEMBL2596534

COc1c(O)ccc2c1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.77
ESR2 Q92731 8/20 0.77
LMNA P02545 6/20 0.77
MEN1 O00255 4/20 0.77
MAPT P10636 4/20 0.77
KMT2A Q03164 4/20 0.77
GAA P10253 3/20 0.77
KDM4E B2RXH2 2/20 0.77
G6PD P11413 2/20 0.77
PKM P14618 2/20 0.77
MAPK1 P28482 2/20 0.77
MPI P34949 1/20 0.77
CYP19A1 P11511 3/20 0.72
STS P08842 2/20 0.67
HSD17B10 Q99714 6/20 0.61
CYP1A2 P05177 3/20 0.60
CYP3A4 P08684 3/20 0.60
CYP1B1 Q16678 3/20 0.60
TSHR P16473 3/20 0.60
CYP1A1 P04798 2/20 0.60

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
SCHEMBL13123060 1.00 ESR1 (0.77) ESR1ESR2LMNAMEN1MAPT
SCHEMBL31544736 1.00 ESR1 (0.77) ESR1ESR2LMNAMEN1MAPT
SCHEMBL1048371 1.00 ESR1 (0.77) ESR1ESR2LMNAMEN1MAPT
SCHEMBL6883109 0.89 ESR1 (0.73) ESR1ESR2LMNAMEN1MAPT
SCHEMBL6883111 0.89 ESR1 (0.73) ESR1ESR2LMNAMEN1MAPT
SCHEMBL4665285 0.89 ESR1 (0.66) ESR1ESR2LMNAMEN1MAPT
SCHEMBL224399 0.87 ESR1 (1.00) ESR1ESR2LMNAMEN1MAPT
SCHEMBL6009933 0.87 ESR1 (1.00) ESR1ESR2LMNAMEN1MAPT
SCHEMBL13123059 0.87 ESR1 (1.00) ESR1ESR2LMNAMEN1MAPT
SCHEMBL224398 0.87 ESR1 (1.00) ESR1ESR2LMNAMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2991621-B1 TWO-LAYER OCULAR IMPLANT RETINA FOUND OF THE SOUTHWEST (US) 2020-12-09 EP claimed
JP-4228116-B2 2009-02-25 JP claimed
US-20080171730-A1 Administration of estradiol metabolites for the treatment or prevention of obesity, metabolic syndrome, diabetes and vascular and renal disorders UNIVERSITY OF PITTSBURGH (US) 2008-07-17 US claimed
EP-1829529-A1 Controlled release compositions of estradiol metabolites PR Pharmaceuticals, Inc. (US) 2007-09-05 EP claimed
EP-1418876-A4 ADMINISTRATION OF ESTRADIOL METABOLITES FOR THE TREATMENT OR PREVENTION OF OBESITY, METABOLIC SYNDROME, DIABETES, AND VASCULAR AND RENAL DISORDERS UNIV PITTSBURGH (US) 2007-07-11 EP claimed
EP-1507514-B1 CONTROLLED RELEASE COMPOSITIONS OF ESTRADIOL METABOLITES PR PHARMACEUTICALS INC (US) 2007-02-14 EP claimed
US-20060083778-A1 Controlled release compositions of estradiol metabolites PR PHARMACEUTICALS INC. 2006-04-20 US claimed
EP-1507514-A4 CONTROLLED RELEASE COMPOSITIONS OF ESTRADIOL METABOLITES PR PHARMACEUTICALS INC (US) 2005-08-10 EP claimed
EP-1549292-A2 PHARMACEUTICAL PREPARATIONS, USE OF SAID PREPARATIONS AND METHOD FOR INCREASING THE BIOAVAILABILITY OF MEDICAMENTS FOR PERORAL ADMINISTRATION Schering Aktiengesellschaft (DE) 2005-07-06 EP claimed
EP-1507514-A2 CONTROLLED RELEASE COMPOSITIONS OF ESTRADIOL METABOLITES PR Pharmaceuticals, Inc. (US) 2005-02-23 EP claimed
WO-2003092585-A2 CONTROLLED RELEASE COMPOSITIONS OF ESTRADIOL METABOLITES PR PHARMACEUTICALS, INC. (US) 2003-11-13 WO claimed
US-20030050294-A1 Administration of estradiol metabolites for the treatment or prevention of obesity, metabolic syndrome, diabetes, and vascular and renal disorders PITTSBURGH, UNIVERSITY OF 2003-03-13 US claimed
WO-2003015704-A2 ADMINISTRATION OF ESTRADIOL METABOLITES FOR THE TREATMENT OR PREVENTION OF OBESITY, METABOLIC SYNDROME, DIABETES, AND VASCULAR AND RENAL DISORDERS UNIVERSITY OF PITTSBURGH (US) 2003-02-27 WO claimed
EP-0923376-A4 TREATMENT OF ASTHMA AND AIRWAY DISEASES AMRAD OPERATIONS PTY LTD (AU) 2001-09-26 EP claimed
JP-2000507923-A 2000-06-27 JP claimed
EP-0923376-A1 TREATMENT OF ASTHMA AND AIRWAY DISEASES Amrad Operations Pty.,Ltd. (AU) 1999-06-23 EP claimed
WO-1999001142-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING AN ANGIOSTATIC STEROID COMBINED WITH A HYALURONAN HYAL PHARMACEUTICAL CORPORATION (CA) 1999-01-14 WO claimed
EP-0866969-A1 METHOD OF CANCER DETECTION IMMUNA CARE CORPORATION (US) 1998-09-30 EP claimed
WO-1997042958-A1 TREATMENT OF ASTHMA AND AIRWAY DISEASES AMRAD OPERATIONS PTY. LTD. (AU) 1997-11-20 WO claimed
WO-1997011374-A1 METHOD OF CANCER DETECTION IMMUNA CARE CORPORATION (US) 1997-03-27 WO claimed