SCHEMBL537084

SCHEMBL537084

N=C(N)NCCC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)NC(=O)c1ccc2ccccc2c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.45
NPY1R P25929 6/20 0.45
NPY2R P49146 4/20 0.45
NPY5R Q15761 4/20 0.45
KISS1R Q969F8 3/20 0.44
ERAP2 Q6P179 1/20 0.43
LNPEP Q9UIQ6 1/20 0.43
METAP2 P50579 1/20 0.42
MCHR1 Q99705 1/20 0.42
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
PADI6 Q6TGC4 1/20 0.41
PADI4 Q9UM07 1/20 0.41
PADI2 Q9Y2J8 1/20 0.41

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
Hydrochloric Acid SCHEMBL7850288 0.99 NPY4R (0.44) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL7549487 0.92 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RMETAP2
SCHEMBL11099634 0.87 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL8512961 0.87 MCHR1 (0.42) NPY4RNPY1RNPY2RNPY5RMETAP2
Hydrochloric Acid SCHEMBL11208857 0.86 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RKISS1R
Pabetan SCHEMBL29894618 0.85 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RKISS1R
Pabetan SCHEMBL21571465 0.85 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RKISS1R
Pabetan SCHEMBL14928984 0.85 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RKISS1R
Pabetan SCHEMBL4546522 0.85 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL8515668 0.85 HDAC1 (0.45) NPY4RNPY1RNPY2RNPY5RMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10876058-B2 Method for prevention of biodeterioration of fuels UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2020-12-29 US claimed
US-10876059-B2 Method for prevention of biodeterioration of fuels UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2020-12-29 US claimed
US-20170260467-A1 METHOD FOR PREVENTION OF BIODETERIORATION OF FUELS GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2017-09-14 US claimed
US-20030171317-A1 Methods and compositions for reducing bacterial tolerance to antibacterials, disinfectants and organic solvents TRUSTEES OF TUFTS COLLEGE 2003-09-11 US claimed
EP-1077718-B1 ENHANCEMENT OF OXAZOLIDINONE ANTIBACTERIAL AGENTS ACTIVITY BY ARGININE DERIVATIVES UPJOHN CO (US) 2002-08-14 EP claimed
EP-1019076-A4 METHODS AND COMPOSITIONS FOR REDUCING BACTERIAL TOLERANCE OF DISINFECTANTS AND ORGANIC SOLVENTS TUFTS COLLEGE (US) 2002-01-23 EP claimed
EP-1019076-A1 METHODS AND COMPOSITIONS FOR REDUCING BACTERIAL TOLERANCE OF DISINFECTANTS AND ORGANIC SOLVENTS TRUSTEES OF TUFTS COLLEGE (US) 2000-07-19 EP claimed
WO-1999017607-A2 METHODS AND COMPOSITIONS FOR REDUCING BACTERIAL TOLERANCE OF DISINFECTANTS AND ORGANIC SOLVENTS TRUSTEES OF TUFTS COLLEGE (US) 1999-04-15 WO claimed
WO-1999017791-A1 METHODS AND COMPOSITIONS FOR REDUCING BACTERIAL TOLERANCE OF DISINFECTANTS AND ORGANIC SOLVENTS TRUSTEES OF TUFTS COLLEGE (US) 1999-04-15 WO claimed
US-12035710-B2 Aqueous hop extracts and their use as antimicrobial agents Nature Recombined Sciences Inc. (CA) 2024-07-16 US disclosed
US-11969476-B2 Antibody molecule-drug conjugates and uses thereof Visterra, Inc. (US) 2024-04-30 US disclosed
EP-3374391-B1 ANTIBODY MOLECULE-DRUG CONJUGATES THAT SPECIFICALLY BINDS TO LIPOPOLYSACCHARIDE AND USES THEREOF VISTERRA INC (US) 2024-04-17 EP disclosed
CN-116459240-B Application of KL-2 and derivatives thereof in preparation of antibacterial infection medicines 华中科技大学协和深圳医院 2024-03-19 CN disclosed
US-11890319-B2 Antibody molecule-drug conjugates and uses thereof Visterra, Inc. (US) 2024-02-06 US disclosed
US-6068972-A SCREENING BY CONTACTING MICROORGANISMS WITH ORGANIC SOLVENT, DETERMINING EXPRESSION OF ACR-LIKE EFFLUX PUMP GENE LOCUS, COMPARING TO CONTROL, ALTERED EXPRESSION INDICATES ACTIVATION OF MULTIPLE ANTIBIOTIC RESISTANCE PHENOTYPE TRUSTEES OF TUFTS COLLEGE (US) 2000-05-30 US disclosed
US-5989832-A Method for screening for non-tetracycline efflux pump inhibitors MICROCIDE PHARMACEUTICALS, INC. (US) 1999-11-23 US disclosed
WO-1999017791-A1 METHODS AND COMPOSITIONS FOR REDUCING BACTERIAL TOLERANCE OF DISINFECTANTS AND ORGANIC SOLVENTS TRUSTEES OF TUFTS COLLEGE (US) 1999-04-15 WO disclosed
WO-1999017607-A2 METHODS AND COMPOSITIONS FOR REDUCING BACTERIAL TOLERANCE OF DISINFECTANTS AND ORGANIC SOLVENTS TRUSTEES OF TUFTS COLLEGE (US) 1999-04-15 WO disclosed
EP-0823942-A1 EFFLUX PUMP INHIBITORS Microcide Pharmaceuticals, Inc. (US) 1998-02-18 EP disclosed
WO-1996033285-A1 EFFLUX PUMP INHIBITORS MICROCIDE PHARMACEUTICALS, INC. (US) 1996-10-24 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 (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-11969476-B2 Antibody molecule-drug conjugates and uses thereof CD14, EPCAM, CD44 NPY4R 4726/4885NPY1R 4837/4885NPY2R 4844/4885
US-11890319-B2 Antibody molecule-drug conjugates and uses thereof CD14, EPCAM, CD44 NPY4R 4726/4885NPY1R 4837/4885NPY2R 4844/4885

“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.