SCHEMBL12083396

SCHEMBL12083396

CCCCCCCCCC(=O)CC(=O)Nc1ccccc1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 1/20 0.57
▸ CETP P11597 2/20 0.56
▸ SOAT1 P35610 3/20 0.55
▸ HDAC3 O15379 2/20 0.50
▸ HDAC1 Q13547 2/20 0.50
▸ P2RX7 Q99572 1/20 0.49
▸ KDM1A O60341 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ SOAT2 O75908 1/20 0.48
▸ HDAC4 P56524 1/20 0.47
▸ HDAC7 Q8WUI4 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ HDAC10 Q969S8 1/20 0.47
▸ HDAC11 Q96DB2 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47

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
SCHEMBL5271392 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL1133527 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL8446067 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL3155514 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL28565040 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL14246925 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL28777021 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL1161259 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL6920533 0.89 EP300 (0.69) EP300CETPSOAT1HDAC3HDAC1
SCHEMBL18073904 0.86 EP300 (0.48) EP300CETPSOAT1HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242951-B2 Covalent inhibition of bacterial quorum sensing The National Institute for Biotechnology in the Negev Ltd. (IL) 2016-01-26 — — US disclosed
US-9000190-B2 Amide compound or salt thereof, biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2015-04-07 — — US disclosed
US-9000190-B2 Amide compound or salt thereof, biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2015-04-07 — — US disclosed
US-20150018564-A1 AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2015-01-15 — — US disclosed
US-20150018564-A1 AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2015-01-15 — — US disclosed
US-8748617-B2 Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2014-06-10 — — US disclosed
US-8748617-B2 Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2014-06-10 — — US disclosed
US-20140073690-A1 COVALENT INHIBITION OF BACTERIAL QUORUM SENSING NAT INST FOR BIOTECHNOLOGY IN THE NEGEV LTD (IL) 2014-03-13 — — US disclosed
US-8507674-B2 Quorum sensing inhibitor THE UNIVERSITY OF TOKYO (JP) 2013-08-13 — — US disclosed
US-8507674-B2 Quorum sensing inhibitor THE UNIVERSITY OF TOKYO (JP) 2013-08-13 — — US disclosed
US-20100256369-A1 QUORUM SENSING INHIBITOR THE UNIVERSITY OF TOKYO (JP) 2010-10-07 — — US disclosed
US-20100256369-A1 QUORUM SENSING INHIBITOR THE UNIVERSITY OF TOKYO (JP) 2010-10-07 — — US disclosed
EP-2215910-A1 QUORUM SENSING INHIBITOR The University of Tokyo (JP) 2010-08-11 — — EP disclosed
EP-2100602-A1 Method and compositions suitable for treatment of wounds QuoNova Europe GmbH (DE) 2009-09-16 — — EP disclosed
US-20090068120-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME OTSUKA CHEMICAL CO., LTD. (JP) 2009-03-12 — — US disclosed
US-20090068120-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME OTSUKA CHEMICAL CO., LTD. (JP) 2009-03-12 — — US disclosed
US-20080241081-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM REMOVER CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2008-10-02 — — US disclosed
US-20080241081-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM REMOVER CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2008-10-02 — — US disclosed
US-20080027115-A1 COMBINATORIAL LIBRARIES OF AUTOINDUCER ANALOGS, AUTOINDUCER AGONISTS AND ANTAGONISTS, AND METHODS OF USE THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2008-01-31 — — US disclosed
US-20080027115-A1 COMBINATORIAL LIBRARIES OF AUTOINDUCER ANALOGS, AUTOINDUCER AGONISTS AND ANTAGONISTS, AND METHODS OF USE THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2008-01-31 — — 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 (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-20150018564-A1 AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME Q6ZSR9, F12, H1-0 EP300 92/4885CETP 3973/4885SOAT1 423/4885
US-20090068120-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME Q6ZSR9, F12, H1-0 EP300 86/4885CETP 4199/4885SOAT1 425/4885
US-20080241081-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM REMOVER CONTAINING THE SAME H1-0, H1-10, H1-4 EP300 133/4885CETP 1381/4885SOAT1 717/4885
US-20140073690-A1 COVALENT INHIBITION OF BACTERIAL QUORUM SENSING BLVRB, DBI, COASY EP300 841/4885CETP 2895/4885SOAT1 921/4885
US-20080027115-A1 COMBINATORIAL LIBRARIES OF AUTOINDUCER ANALOGS, AUTOINDUCER AGONISTS AND ANTAGONISTS, AND METHODS OF USE THEREOF QRFPR, CASR, BLVRB EP300 3465/4885CETP 4423/4885SOAT1 1388/4885
US-20100256369-A1 QUORUM SENSING INHIBITOR BLVRB, API5, Q6ZSR9 EP300 3678/4885CETP 4286/4885SOAT1 1542/4885

“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.

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