SCHEMBL535683

SCHEMBL535683

COc1cc(C(N)=O)cc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.49
APOBEC3A P31941 1/20 0.49
HTT P42858 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
MAPK1 P28482 1/20 0.46
ALOX15 P16050 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.46
SIRT1 Q96EB6 1/20 0.46
SIRT3 Q9NTG7 1/20 0.46
PARP1 P09874 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 3/20 0.44
KMT2A Q03164 1/20 0.44
PARP15 Q460N3 1/20 0.44
PARP10 Q53GL7 1/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL31281188 1.00 TSHR (0.49) TSHRAPOBEC3AHTTAPOBEC3GMAPK1
Hydrochloric Acid SCHEMBL22445134 0.98 TSHR (0.47) TSHRAPOBEC3AHTTAPOBEC3GMAPK1
SCHEMBL18288064 0.85 ALOX15 (0.55) TSHRHTTALOX15CYP1A2CYP2C19
SCHEMBL31493128 0.83 HPGD (0.53) TSHRHTTALOX15CYP3A4ALDH1A1
SCHEMBL18288014 0.83 HPGD (0.53) TSHRHTTALOX15CYP3A4ALDH1A1
SCHEMBL9117716 0.83 ALOX15 (0.46) TSHRALOX15CYP1A2CYP3A4CYP2C9
SCHEMBL18288083 0.82 HPGD (0.53) TSHRMAPK1ALOX15CYP1A2CYP3A4
SCHEMBL15774869 0.80 TSHR (0.53) TSHRAPOBEC3AHTTAPOBEC3GMAPK1
SCHEMBL18288093 0.78 TUBB4A (0.63) TSHRHTTMAPK1CYP1A2CYP3A4
SCHEMBL18639610 0.78 MAPT (0.46) MAPK1ALOX15CYP1A2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1352083-B2 COMPOSITIONS AND METHODS FOR DETECTING TARGET MICROORGANISMS IN A SAMPLE BIOCONTROL SYSTEMS INC (US) 2013-12-25 EP claimed
EP-1500707-B1 METHOD OF MEASURING NEPRILYSIN ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2010-09-15 EP claimed
US-7572574-B2 Method of measuring neprilysin activity RIKEN (JP) 2009-08-11 US claimed
US-20060008842-A1 Method of measuring neprilysin activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-12 US claimed
EP-1352083-B1 COMPOSITIONS AND METHODS FOR DETECTING TARGET MICROORGANISMS IN A SAMPLE BIOCONTROL SYSTEMS INC (US) 2005-10-26 EP claimed
EP-0946746-B1 METHOD AND MEDIA FOR THE DETECTION OF YEASTS AND/OR MOLDS IN A SAMPLE BIOCONTROL SYSTEMS INC (US) 2005-03-02 EP claimed
EP-1500707-A1 METHOD OF MEASURING NEPRILYSIN ACTIVITY Riken (JP) 2005-01-26 EP claimed
EP-1156105-B1 ALPHA-GLYCATED AMINO ACID RELEASING ENZYME ARKRAY INC (JP) 2004-09-01 EP claimed
EP-1352083-A2 COMPOSITIONS AND METHODS FOR DETECTING TARGET MICROORGANISMS IN A SAMPLE BioControl Systems, Inc. (US) 2003-10-15 EP claimed
US-20020058298-A1 Compositions and methods for detecting target microorganisms in a sample BIOCONTROL SYSTEM, INC. (US) 2002-05-16 US claimed
EP-1156105-A1 NOVEL ENZYME ARKRAY, Inc. (JP) 2001-11-21 EP claimed
US-6022698-A Method and components for the detection of yeasts and/or molds in a sample IDEXX LABORATORIES, INCORPORATED (US) 2000-02-08 US claimed
US-5962216-A MARKER OR ANTICARCINOGENIC/ANTIINFLAMMATORY/ANTITUMOR AGENT LINKED BY CLEAVABLE SEQUENCE TO STABILIZER OF BETA-ALANINE OR SUCCINIC ACID; TARGETED DELIVERY TO CELL, CLEAVAGE BY CELL SPECIFIC FACTOR FOR ENTRY INTO CELL OR EXPRESSION OF MARKER LA REGION WALLONNE (BE) 1999-10-05 US claimed
US-5854011-A Method and components for the detection of yeasts and/or molds in a sample IDEXX LABORATORIES INCORPORATED (US) 1998-12-29 US claimed
EP-0769967-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND DIAGNOSTIC DEVICE COMPRISING SAME AND THEIR USE UNIVERSITE CATHOLIQUE DE LOUVAIN (BE) 1997-05-02 EP claimed
WO-1996020949-A1 PEPTIDE AND PEPTIDE ANALOG PROTEASE INHIBITORS SIBIA NEUROSCIENCES, INC. (US) 1996-07-11 WO claimed
WO-1996020725-A2 PEPTIDE, PEPTIDE ANALOG AND AMINO ACID ANALOG PROTEASE INHIBITORS SIBIA NEUROSCIENCES, INC. (US) 1996-07-11 WO claimed
WO-1996005863-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND DIAGNOSTIC DEVICE COMPRISING SAME AND THEIR USE LA REGION WALLONNE (BE) 1996-02-29 WO claimed
US-4335204-A Easily split substrates for the quantification of proteases KABI AB (SE) 1982-06-15 US claimed
US-4279810-A Easily split substrates for the quantification of proteases KABI AB (SE) 1981-07-21 US claimed