SCHEMBL132483

SCHEMBL132483

CCCCCCCCCCCCCC(=O)N[C@@H](CCO)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 12/20 0.77
SLC6A5 Q9Y345 2/20 0.60
FAAH O00519 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MAPK1 P28482 1/20 0.56
PLA2G2C Q5R387 1/20 0.54
EPHX2 P34913 1/20 0.51
DNM1 Q05193 1/20 0.50

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
SCHEMBL3751271 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL17941648 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL6579626 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL131586 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL9829340 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL22996019 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL17941649 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL9829330 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL5122358 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A
SCHEMBL5888062 1.00 NOD1 (0.77) NOD1SLC6A5FAAHMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730197-B1 METHODS FOR INDUCING AUTOLYSIS IN INFECTIOUS BACTERIA HAPTOGEN LTD (GB) 2012-03-07 EP claimed
CN-110023251-B Biological bead for biofouling control in membrane bioreactors 南洋理工大学 2022-03-11 CN disclosed
US-8932807-B2 High throughput in vitro translation (cell-lysate based) assay for detecting quorum sensing signals UNIVERSITY OF SOUTH CAROLINA (US) 2015-01-13 US disclosed
US-20140030750-A1 High Throughput In Vitro Translation (Cell-Lysate Based) Assay for Detecting Quorum Sensing Signals DECHO ALAN W (US) 2014-01-30 US disclosed
US-8546071-B2 High-throughput in vitro translation (cell-lysate based) assay for detecting quorum sensing signals UNIVERSITY OF SOUTH CAROLINA (US) 2013-10-01 US disclosed
US-20120164672-A1 HIGH-THROUGHPUT IN VITRO TRANSLATION (CELL-LYSATE BASED) ASSAY FOR DETECTING QUORUM SENSING SIGNALS UNIVERSITY OF SOUTH CAROLINA (US) 2012-06-28 US disclosed
US-20100291566-A1 SYSTEMS AND METHODS FOR DIAGNOSIS AND MONITORING OF BACTERIA-RELATED CONDITIONS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2010-11-18 US disclosed
WO-2009036081-A1 SYSTEMS AND METHODS FOR DIAGNOSIS AND MONITORING OF BACTERIA-RELATED CONDITIONS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2009-03-19 WO disclosed
US-7442798-B2 Quinone-indicator antibiotics, particularly2-heptyl-3-hydroxy-4-quinolone, and analogs; regulating the expression of a bacterial gene; modulating bacteria quorum sensing signaling THE UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2008-10-28 US disclosed
US-20050227345-A1 Quorum sensing signaling in bacteria AURORA BIOSCIENCES CORPORATION (US) 2005-10-13 US disclosed
US-6855513-B1 Quorum sensing signaling in bacteria UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2005-02-15 US disclosed
US-20050009869-A1 Novel autoinducer molecules and uses therefor NATIONAL SCIENCE FOUNDATION 2005-01-13 US disclosed
US-6723321-B2 MODULATION OF LYASE ACTIVITY; OBTAIN SAMPLE CONTAINING LYASE, INCUBATE WITH SUBSTRATE AND MODULATOR, MONITOR ADJUSTMENT IN BINDING OF SUBSTRATE TO LYASE, ADJUSTMENT IN BINDING INDICATES MODULATOR THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2004-04-20 US 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 (2 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-20050227345-A1 Quorum sensing signaling in bacteria PGLS, Q6ZSR9, FDPS NOD1 1892/4885SLC6A5 2123/4885FAAH 1802/4885
US-20050009869-A1 Novel autoinducer molecules and uses therefor QARS1, PGLS, SQLE NOD1 272/4885SLC6A5 3212/4885FAAH 1450/4885

“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.