Tamoxifen

Tamoxifen

SCHEMBL3046696

CC/C(=C(\c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1.[PbH2]

nearest known ligand 0.97

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 0.97
ESR2 Q92731 6/20 0.97
MAPT P10636 3/20 0.97
MEN1 O00255 3/20 0.97
TP53 P04637 3/20 0.97
CYP3A4 P08684 3/20 0.97
KMT2A Q03164 3/20 0.97
ESRRG P62508 3/20 0.97
PGR P06401 2/20 0.97
CYP1A2 P05177 2/20 0.97
CYP2D6 P10635 2/20 0.97
HTR6 P50406 2/20 0.97
NPC1 O15118 1/20 0.97
NR1I2 O75469 1/20 0.97
PRKD3 O94806 1/20 0.97
ABCB11 O95342 1/20 0.97
EGFR P00533 1/20 0.97
GBA1 P04062 1/20 0.97
NR3C1 P04150 1/20 0.97
ERBB2 P04626 1/20 0.97

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
SCHEMBL29659348 0.99 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL17262111 0.99 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL4084 0.99 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL17262082 0.99 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL4085 0.99 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL1056785 0.99 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL119181 0.99 ESR1 (1.00) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL3794383 0.97 ESR1 (0.97) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL17629799 0.97 ESR1 (0.97) ESR1ESR2MAPTMEN1TP53
Tamoxifen SCHEMBL4323842 0.97 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110167564-A Modulation of tjp1 expression to regulate regeneration of cardiac cells 新加坡科技研究局 2019-08-23 CN disclosed
CN-108938613-A The purposes of tamoxifen and a kind of method for constructing cleft palate animal model 首都医科大学附属北京口腔医院 2018-12-07 CN disclosed
US-8377886-B2 Use of gamma secretase inhibitors and notch pathway inhibitors for treatment and prevention of renal disease ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2013-02-19 US disclosed
US-20100222283-A1 USE OF GAMMA SECRETASE INHIBITORS AND NOTCH PATHWAY INHIBITORS FOR TREATMENT AND PREVENTION OF RENAL DESEASE ALBERT EINSTEIN COLLEGE OF MEDICINE 2010-09-02 US disclosed
WO-2009035522-A1 USE OF GAMMA SECRETASE INHIBITORS AND NOTCH PATHWAY INHIBITORS FOR TREATMENT AND PREVENTION OF RENAL DISEASE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2009-03-19 WO disclosed
US-20080318839-A1 Ligand activated transcriptional regulator proteins THE SCRIPPS RESEARCH INSTITUTE 2008-12-25 US disclosed
US-7442784-B2 Ligand activated transcriptional regulator proteins THE SCRIPPS RESEARCH INSTITUTE (US) 2008-10-28 US disclosed
US-7329728-B1 Ligand activated transcriptional regulator proteins THE SCRIPPS RESEARCH INSTITUTE (US) 2008-02-12 US disclosed
US-20030186841-A1 Ligand activated transcriptional regulator proteins NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-10-02 US disclosed
WO-2001030843-A9 LIGAND ACTIVATED TRANSCRIPTIONAL REGULATOR PROTEINS NOVARTIS AG (CH) 2002-09-19 WO disclosed
EP-1226168-A1 LIGAND ACTIVATED TRANSCRIPTIONAL REGULATOR PROTEINS Novartis AG (CH) 2002-07-31 EP disclosed
WO-2001030843-A1 LIGAND ACTIVATED TRANSCRIPTIONAL REGULATOR PROTEINS NOVARTIS AG (CH) 2001-05-03 WO 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 (1 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-20100222283-A1 USE OF GAMMA SECRETASE INHIBITORS AND NOTCH PATHWAY INHIBITORS FOR TREATMENT AND PREVENTION OF RENAL DESEASE BACE1, GSAP, BACE2 ESR1 3627/4885ESR2 1337/4885MAPT 1834/4885

“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.