SCHEMBL1332095

SCHEMBL1332095

N/C(=C/C=C\C(=O)O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
TP53 P04637 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
EGLN3 Q9H6Z9 1/20 0.40
TDP1 Q9NUW8 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HSD17B10 Q99714 3/20 0.39
ALOX15 P16050 2/20 0.39
RECQL P46063 2/20 0.39
GABRR1 P24046 2/20 0.35
GABRR2 P28476 2/20 0.35
BLM P54132 2/20 0.35
GABRR3 A8MPY1 1/20 0.35
LMNA P02545 1/20 0.35
APEX1 P27695 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL28816 1.00 TSHR (0.40) TSHRTP53EGLN1EGLN3TDP1
SCHEMBL28815 1.00 TSHR (0.40) TSHRTP53EGLN1EGLN3TDP1
SCHEMBL637960 0.74 LDHA (0.33) LDHALDHBACHE
SCHEMBL13176449 0.74 LDHA (0.33) LDHALDHBACHE
SCHEMBL14784817 0.74 LDHA (0.33) LDHALDHBACHE
SCHEMBL28895629 0.74
SCHEMBL454524 0.72 TSHR (0.44) TSHRTP53EGLN1EGLN3TDP1
SCHEMBL529628 0.72 TSHR (0.44) TSHRTP53EGLN1EGLN3TDP1
SCHEMBL19379407 0.72 TSHR (0.44) TSHRTP53EGLN1EGLN3TDP1
SCHEMBL454525 0.72 TSHR (0.44) TSHRTP53EGLN1EGLN3TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658402-A1 METAL ORGANIC FRAMEWORKS POLYMORPHISM FOR ADSORPTION PROFILE TUNING Centre National de la Recherche Scientifique (FR) 2025-12-10 EP claimed
WO-2025072741-A1 PRESERVATIVES FOR MOLECULAR SAMPLE ANALYSIS WITH SAMPLE COLLECTION DEVICES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 WO claimed
WO-2024160984-A1 METAL ORGANIC FRAMEWORKS POLYMORPHISM FOR ADSORPTION PROFILE TUNING CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2024-08-08 WO claimed
EP-4410419-A1 METAL ORGANIC FRAMEWORKS POLYMORPHISM FOR ADSORPTION PROFILE TUNING Centre National de la Recherche Scientifique (FR) 2024-08-07 EP claimed
WO-2023114656-A1 METHODS FOR TREATING AND PREVENTING DISEASES AND DISORDER THROUGH MODULATION OF NAD MARK PAUL (US) 2023-06-22 WO claimed
WO-2018191771-A1 DETECTION AND TREATMENT OF CONGENITAL MALFORMATIONS VICTOR CHANG CARDIAC RESEARCH INSTITUTE (AU) 2018-10-25 WO claimed
EP-2164500-B1 THE USE OF ZEBURALINE FOR THE TREATMENT OF AUTOIMMUNE DISEASES OR IMMUNE REJECTION OF TRANSPLANTS IDOGEN AB (SE) 2013-12-04 EP claimed
US-6432683-B1 Preparation of 2-aminomuconate from 2-aminophenol by coupled enzymatic dioxygenation and dehydrogenation reactions THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2002-08-13 US claimed
WO-2001077366-A1 POSITIVE SELECTION METHOD, COMPOUNDS, HOST CELLS AND USES THEREOF CUBIST PHARMACEUTICALS, INC. (US) 2001-10-18 WO claimed
EP-4658402-A1 METAL ORGANIC FRAMEWORKS POLYMORPHISM FOR ADSORPTION PROFILE TUNING Centre National de la Recherche Scientifique (FR) 2025-12-10 EP disclosed
CN-116635036-B Nicotinamide mononucleotide derivatives and their use in the treatment and prevention of red blood cell disorders 努瓦米德股份有限公司 2025-06-17 CN disclosed
WO-2025072741-A1 PRESERVATIVES FOR MOLECULAR SAMPLE ANALYSIS WITH SAMPLE COLLECTION DEVICES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 WO disclosed
US-20250044306-A1 Methods for Determining Opioid Responsiveness in the Treatment of Pain EAST CAROLINA UNIVERSITY 2025-02-06 US disclosed
WO-2024160984-A1 METAL ORGANIC FRAMEWORKS POLYMORPHISM FOR ADSORPTION PROFILE TUNING CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2024-08-08 WO disclosed
US-20070298484-A1 Method and Device for Thermal Conditioning of a Cell INSILICO BIOTECHNOLOGY GMBH (DE) 2007-12-27 US disclosed
US-20060051782-A1 Directed evolution of recombinant monooxygenase nucleic acids and related polypeptides and methods of use UNIVERSITY OF CONNECTICUT 2006-03-09 US disclosed
US-6432683-B1 Preparation of 2-aminomuconate from 2-aminophenol by coupled enzymatic dioxygenation and dehydrogenation reactions THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2002-08-13 US disclosed
US-6432683-B1 Preparation of 2-aminomuconate from 2-aminophenol by coupled enzymatic dioxygenation and dehydrogenation reactions THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2002-08-13 US disclosed
US-6432683-B1 Preparation of 2-aminomuconate from 2-aminophenol by coupled enzymatic dioxygenation and dehydrogenation reactions THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2002-08-13 US disclosed
WO-2001077366-A1 POSITIVE SELECTION METHOD, COMPOUNDS, HOST CELLS AND USES THEREOF CUBIST PHARMACEUTICALS, INC. (US) 2001-10-18 WO disclosed