SCHEMBL2028036

SCHEMBL2028036

C1CCC(NC2CCCCC2)CC1.C=CCNCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 1/20 0.40
ADH1B P00325 2/20 0.38
ADH1C P00326 2/20 0.38
ADH1A P07327 2/20 0.38
ADH4 P08319 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
EPHX2 P34913 1/20 0.37
KMT2A Q03164 2/20 0.37
THRB P10828 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
EPHX1 P07099 2/20 0.36
HPGD P15428 1/20 0.36
GAA P10253 1/20 0.35
ADH7 P40394 1/20 0.35
HTT P42858 1/20 0.35
NPC1 O15118 1/20 0.35

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
Biphenyl SCHEMBL15166643 0.85 ALDH1A1 (0.39) LMNAALDH1A1NPSR1EPHX2KMT2A
SCHEMBL3946913 0.80 MAPT (0.44) LMNAALDH1A1HSD17B10KMT2AHPGD
SCHEMBL29438 0.80
SCHEMBL10869584 0.78
Hydrochloric Acid SCHEMBL4732743 0.78
Water SCHEMBL7160929 0.78
SCHEMBL7184515 0.78
Ammonia Solution, Strong SCHEMBL28182267 0.78
SCHEMBL27814238 0.78 ABCC4 (0.62) LMNAALDH1A1EPHX2EPHX1GAA
Oxalic Acid SCHEMBL28044433 0.76 MAPT (0.41) ALDH1A1HSD17B10KMT2AGAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240131032-A1 AN ACTIVITY-GUIDED MAP OF ELECTROPHILE-CYSTEINE INTERACTIONS IN PRIMARY HUMAN IMMUNE CELLS THE SCRIPPS RESEARCH INSTITUTE 2024-04-25 US disclosed
WO-2024083220-A1 LIGAND-OLIGONUCLEOTIDE CONJUGATE AND LINKER FOR CONJUGATE 上海京新生物医药有限公司 2024-04-25 WO disclosed
EP-4355755-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS Venatorx Pharmaceuticals, Inc. (US) 2024-04-24 EP disclosed
US-20240123078-A1 COMPOUNDS AND METHODS FOR MODULATING IMMUNE-RELATED PROTEINS VIVIDION THERAPEUTICS, INC. 2024-04-18 US disclosed
US-11957787-B2 Wnt compositions and methods for purification THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2024-04-16 US disclosed
US-20240117363-A1 PRODUCTION OF UNNATURAL NUCLEOTIDES USING A CRISPR/CAS9 SYSTEM THE SCRIPPS RESEARCH INSTITUTE 2024-04-11 US disclosed
WO-2024043250-A1 CYCLIC PEPTIDE OR SALT THEREOF, AND MDMX INHIBITOR 富士フイルム株式会社 2024-02-29 WO disclosed
WO-2024043249-A1 CYCLIC PEPTIDE OR SALT THEREOF AND MDMX INHIBITOR 富士フイルム株式会社 2024-02-29 WO disclosed
US-11879145-B2 Reagents and methods for replication, transcription, and translation in semi-synthetic organisms THE SCRIPPS RESEARCH INSTITUTE (US) 2024-01-23 US disclosed
US-20230372536-A1 NANOMATERIAL AND METHODS OF USE THEREOF UNIVERSITY OF CONNECTICUT 2023-11-23 US disclosed
US-20110236429-A1 Small Cationic Antimicrobial Peptides THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2011-09-29 US disclosed
US-20110150917-A1 Small Cationic Antimicrobial Peptides THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2011-06-23 US disclosed
EP-2061886-A1 SMALL CATIONIC ANTIMICROBIAL PEPTIDES The University of British Columbia (CA) 2009-05-27 EP disclosed
WO-2008151434-A1 SMALL CATIONIC ANTIMICROBIAL PEPTIDES THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2008-12-18 WO disclosed
US-20080139456-A1 Macrocyclic Sh2 Domain Binding Inhibitors GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2008-06-12 US disclosed
EP-1919866-A2 SUBSTITUTED INDOLES AND USE THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-05-14 EP disclosed
WO-2008022444-A1 SMALL CATIONIC ANTIMICROBIAL PEPTIDES THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2008-02-28 WO disclosed
EP-1793843-A1 MACROCYCLIC SH2 DOMAIN BINDING INHIBITORS Government of the United States of America, Represented by the Secretary, Department of Health and Human Services (US) 2007-06-13 EP disclosed
WO-2007022321-A2 SUBSTITUTED INDOLES AND USE THEREOF WYETH (US) 2007-02-22 WO disclosed
WO-2006039527-A1 MACROCYCLIC SH2 DOMAIN BINDING INHIBITORS GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-04-13 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 (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-11957787-B2 Wnt compositions and methods for purification WNT3A, CTNNBL1, WNT1 LMNA 1788/4885ALDH1A1 4235/4885HSD17B10 2664/4885
US-20240123078-A1 COMPOUNDS AND METHODS FOR MODULATING IMMUNE-RELATED PROTEINS CD4, ICOS, NFATC1 LMNA 4512/4885ALDH1A1 4719/4885HSD17B10 3967/4885
US-20240131032-A1 AN ACTIVITY-GUIDED MAP OF ELECTROPHILE-CYSTEINE INTERACTIONS IN PRIMARY HUMAN IMMUNE CELLS GSTK1, GSTA2, GSTA1 LMNA 4748/4885ALDH1A1 1423/4885HSD17B10 1294/4885
US-20080139456-A1 Macrocyclic Sh2 Domain Binding Inhibitors ACP1, PPM1D, LASP1 LMNA 4764/4885ALDH1A1 3383/4885HSD17B10 2356/4885
US-20230372536-A1 NANOMATERIAL AND METHODS OF USE THEREOF ILK, EPCAM, MMP8 LMNA 1494/4885ALDH1A1 1432/4885HSD17B10 4446/4885
US-11879145-B2 Reagents and methods for replication, transcription, and translation in semi-synthetic organisms RNGTT, MAX, POLRMT LMNA 2576/4885ALDH1A1 4610/4885HSD17B10 4106/4885

“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.