Raloxifene

Raloxifene

SCHEMBL3162158

O=C(c1ccc(OCCN2CCCCC2)cc1)c1c(-c2ccc(O)cc2)sc2cc(O)ccc12.O=C(c1ccc(OCCN2CCCCC2)cc1)c1c(-c2ccc(O)cc2)sc2cc(O)ccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1ESR2

The experimentally established mechanism targets of Raloxifene. 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 20/20 1.00
ESR2 known ✓ Q92731 19/20 1.00
MEN1 O00255 2/20 1.00
ALDH1A1 P00352 2/20 1.00
LMNA P02545 2/20 1.00
TP53 P04637 2/20 1.00
CYP3A4 P08684 2/20 1.00
MAPT P10636 2/20 1.00
ALOX15 P16050 2/20 1.00
KMT2A Q03164 2/20 1.00
HSD17B10 Q99714 2/20 1.00
TDP1 Q9NUW8 2/20 1.00
PLD2 O14939 1/20 1.00
KDM1A O60341 1/20 1.00
NR1I2 O75469 1/20 1.00
USP2 O75604 1/20 1.00
C5 P01031 1/20 1.00
FYN P06241 1/20 1.00
PGR P06401 1/20 1.00
ADRA2A P08913 1/20 1.00

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
Raloxifene SCHEMBL6144 1.00 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL29362592 1.00 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL9145135 1.00 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
SCHEMBL5821250 1.00 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL9201404 0.99 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL1665344 0.99 ESR1 (0.98) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL1665291 0.99 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
SCHEMBL7630144 0.99 ESR1 (0.98) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL12485521 0.99 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL973873 0.99 ESR1 (0.98) ESR1ESR2MEN1ALDH1A1LMNA

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3675838-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS Puretecch LYT, Inc. (US) 2020-07-08 EP disclosed
WO-2019046491-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS ARIYA THERAPEUTICS, INC. (US) 2019-03-07 WO disclosed
EP-2245052-A2 SELECTIVE EXOSITE INHIBITION OF PAPP-A ACTIVITY AGAINST IGFBP-4 Aarhus Universitet (DK) 2010-11-03 EP disclosed
EP-2167076-A2 HYDROXYPROLINE COMPOSITIONS AND USES THEREOF Bergen Teknologioverforing AS (NO) 2010-03-31 EP disclosed
WO-2009092806-A2 SELECTIVE EXOSITE INHIBITION OF PAPP-A ACTIVITY AGAINST IGFBP-4 AARHUS UNIVERSITET (DK) 2009-07-30 WO disclosed
WO-2008148873-A2 HYDROXYPROLINE COMPOSITIONS AND USES THEREOF BERGEN TEKNOLOGIOVERFØRING AS (NO) 2008-12-11 WO disclosed
CN-1184895-C Soybean composition and application thereof for promoting health TABOR AARON (US) 2005-01-19 CN disclosed
CN-1277540-A Soybean formula and application thereof in health promotion AARON TABOR (US) 2000-12-20 CN disclosed
EP-0777476-A4 METHODS OF INHIBITING ENDOMETRIAL CANCER LILLY CO ELI (US) 1999-06-23 EP disclosed
EP-0782446-A4 METHODS OF INHIBITING ENDOMETRIAL MITOSES LILLY CO ELI (US) 1999-01-07 EP disclosed
US-5843964-A Methods of inhibiting endometrial mitoses ELI LILLY AND COMPANY (US) 1998-12-01 US disclosed
US-5747510-A 2-HYDROXYPHENYL-3-/P-/2-MORPHOLINOETHOXY/BENZOYL/-6-HYDROXY-BE NZOTHIOPHENE, INHIBITING BONE LOSS, LOWERING SERUM CHOLESTEROL ELI LILLY AND COMPANY (US) 1998-05-05 US disclosed
EP-0782446-A1 METHODS OF INHIBITING ENDOMETRIAL MITOSES ELI LILLY AND COMPANY (US) 1997-07-09 EP disclosed
US-5641790-A PHARMACEUTICAL FORMULATION IN LOW DOSAGE UNIT FORM CONTAINING 2-PHENYL-3-AROYLBENZOTHIOPHENE DERIVATIVE ELI LILLY AND COMPANY (US) 1997-06-24 US disclosed
EP-0777476-A1 METHODS OF INHIBITING ENDOMETRIAL CANCER ELI LILLY AND COMPANY (US) 1997-06-11 EP disclosed
US-5610168-A ADMINISTERING RALOXIFENE, A BENZOTHIOPHENE DERIVATIVE, TREATMENT OF OSTEOPOROSIS ELI LILLY AND COMPANY (US) 1997-03-11 US disclosed
WO-1996009050-A1 METHODS OF INHIBITING ENDOMETRIAL MITOSES ELI LILLY AND COMPANY (US) 1996-03-28 WO disclosed
WO-1996005833-A1 METHODS OF INHIBITING ENDOMETRIAL CANCER ELI LILLY AND COMPANY (US) 1996-02-29 WO disclosed