Tamoxifen

Tamoxifen

SCHEMBL119181

CC/C(=C(\c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1.CC/C(=C(\c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1

The experimentally established mechanism targets of Tamoxifen. 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 8/20 1.00
ESR2 Q92731 6/20 1.00
MAPT P10636 3/20 1.00
MEN1 O00255 3/20 1.00
TP53 P04637 3/20 1.00
CYP3A4 P08684 3/20 1.00
KMT2A Q03164 3/20 1.00
ESRRG P62508 3/20 1.00
PGR P06401 2/20 1.00
CYP1A2 P05177 2/20 1.00
CYP2D6 P10635 2/20 1.00
HTR6 P50406 2/20 1.00
NPC1 O15118 1/20 1.00
NR1I2 O75469 1/20 1.00
PRKD3 O94806 1/20 1.00
ABCB11 O95342 1/20 1.00
EGFR P00533 1/20 1.00
GBA1 P04062 1/20 1.00
NR3C1 P04150 1/20 1.00
ERBB2 P04626 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
Tamoxifen SCHEMBL17262082 1.00 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
SCHEMBL29659348 1.00 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL4084 1.00 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL1056785 1.00 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL4085 1.00 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL17262111 1.00 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL5789295 0.99 ESR1 (0.97) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL3794383 0.99 ESR1 (0.97) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL4323848 0.99 ESR1 (0.97) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL4323842 0.99 ESR1 (0.97) ESR1ESR2MAPTMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102458404-A Treatment of hot flashes, vasomotor symptoms and night sweats with sex steroid precursors in combination with selective estrogen receptor modulators ENDORECH INC 2012-05-16 CN claimed
CN-1630516-A Combinations of antibodies selective for a tumor necrosis factor-related apoptosis-inducing ligand receptor and other therapeutic agents UAB RESEARCH FOUNDATION (US) 2005-06-22 CN claimed
US-11633414-B2 Nicotinoyl riboside compositions and methods of use CORNELL UNIVERSITY (US) 2023-04-25 US disclosed
US-20210353657-A1 NICOTINOYL RIBOSIDE COMPOSITIONS AND METHODS OF USE CORNELL UNIVERSITY (US) 2021-11-18 US disclosed
US-11077129-B2 Nicotinoyl riboside compositions and methods of use CORNELL UNIVERSITY (US) 2021-08-03 US disclosed
EP-3730507-A1 NICOTINOYL RIBOSIDE AND NICOTINAMIDE RIBOSIDE COMPOSITIONS FOR USE IN REDUCING TOXICITY INDUCED BY HMG-COA REDUCTASE INHIBITORS Cornell Research Foundation, Inc. (US) 2020-10-28 EP disclosed
US-20200289535-A1 NICOTINOYL RIBOSIDE COMPOSITIONS AND METHODS OF USE CORNELL UNIVERSITY 2020-09-17 US disclosed
US-10668096-B2 Nicotinoyl riboside compositions and methods of use CORNELL UNIVERSITY (US) 2020-06-02 US disclosed
CN-110075097-A Pharmaceutical preparation based on genotype or phenotype 拜耳股份公司 2019-08-02 CN disclosed
US-20190192542-A1 NICOTINOYL RIBOSIDE COMPOSITIONS AND METHODS OF USE CORNELL UNIVERSITY 2019-06-27 US disclosed
CN-109852671-A The probabilistic Modeling assessment cell signaling pathway activity expressed using target gene 皇家飞利浦有限公司 2019-06-07 CN disclosed
EP-1670942-A2 GENETIC ANALYSIS FOR STRATIFICATION OF BREAST CANCER RISK InterGenetics, Inc. (US) 2006-06-21 EP disclosed
EP-1620569-A2 A FORWARD MUTATION ASSAY BASED ON 5-FLUOROURACIL RESISTANCE Merck & Co., Inc. (US) 2006-02-01 EP disclosed
WO-2005024067-A2 GENETIC ANALYSIS FOR STRATIFICATION OF BREAST CANCER RISK INTERGENETICS, INC. (US) 2005-03-17 WO disclosed
CN-1560002-A Synthesizing compound of 1,1,2 triaromatic radical-1,3 butadiene kind by suzuki-miyaura coupling reaction 中国科学院上海有机化学研究所 2005-01-05 CN disclosed
WO-2004096987-A2 A FORWARD MUTATION ASSAY BASED ON 5-FLUOROURACIL RESISTANCE MERCK & CO., INC. (US) 2004-11-11 WO disclosed
EP-1159619-A2 METHODS OF DIAGNOSING AND TREATING BREAST CANCER EOS Biotechnology, Inc. (US) 2001-12-05 EP disclosed
WO-2000055629-A2 METHODS OF DIAGNOSING AND TREATING BREAST CANCER EOS BIOTECHNOLOGY, INC. (US) 2000-09-21 WO disclosed
EP-0616812-B1 Combination with anti-hormonal compounds and binding molecules for the treatment of cancer BERLEX BIOSCIENCES (US) 1999-11-03 EP disclosed
EP-0616812-A1 Combination with anti-hormonal compounds and binding molecules for the treatment of cancer BERLEX BIOSCIENCES (US) 1994-09-28 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11077129-B2 Nicotinoyl riboside compositions and methods of use NNT, CD38, NAMPT ESR1 3315/4885ESR2 3399/4885MAPT 3467/4885
US-20190192542-A1 NICOTINOYL RIBOSIDE COMPOSITIONS AND METHODS OF USE NNT, CD38, NAMPT ESR1 3315/4885ESR2 3399/4885MAPT 3467/4885
US-20200289535-A1 NICOTINOYL RIBOSIDE COMPOSITIONS AND METHODS OF USE NNT, CD38, NAMPT ESR1 3315/4885ESR2 3399/4885MAPT 3467/4885
US-10668096-B2 Nicotinoyl riboside compositions and methods of use NNT, CD38, NAMPT ESR1 3315/4885ESR2 3399/4885MAPT 3467/4885
US-20210353657-A1 NICOTINOYL RIBOSIDE COMPOSITIONS AND METHODS OF USE NNT, CD38, NAMPT ESR1 3315/4885ESR2 3399/4885MAPT 3467/4885
US-11633414-B2 Nicotinoyl riboside compositions and methods of use NNT, CD38, NAMPT ESR1 3315/4885ESR2 3399/4885MAPT 3467/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.