SCHEMBL5706271

SCHEMBL5706271

CCC(NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TYMS P04818 3/20 0.54
F2 P00734 2/20 0.53
EDNRA P25101 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
HDAC5 Q9UQL6 1/20 0.53
PRSS1 P07477 1/20 0.52
PRSS2 P07478 1/20 0.52
PRSS3 P35030 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
HTT P42858 1/20 0.51
HIF1A Q16665 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL9751607 0.90 TYMS (0.52) TYMSF2EDNRA
SCHEMBL5149283 0.90 TYMS (0.52) TYMSF2EDNRA
SCHEMBL6266410 0.90 TYMS (0.54) TYMSF2EDNRAPRSS1PRSS2
SCHEMBL180018 0.89 TYMS (0.53) TYMSF2EDNRAPRSS1PRSS2
SCHEMBL13066809 0.89 TYMS (0.53) TYMSF2EDNRAPRSS1PRSS2
SCHEMBL8842854 0.89 TYMS (0.53) TYMSF2EDNRAPRSS1PRSS2
SCHEMBL180019 0.89 TYMS (0.53) TYMSF2EDNRAPRSS1PRSS2
SCHEMBL13884437 0.89 TYMS (0.53) TYMSF2EDNRAPRSS1PRSS2
SCHEMBL1168294 0.88
SCHEMBL10963011 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5541633-A Ink jet printing of concealed images on carbonless paper XEROX CORPORATION (US) 1996-07-30 US claimed
US-5286286-A Containing diethylene glycol monobutyl ether, glycerol, and a dansyl or porphyrin chromophores XEROX CORPORATION (US) 1994-02-15 US claimed
EP-0748247-B1 Macrocyclic antibiotics as separation agents UNIV MISSOURI (US) 2012-06-20 EP disclosed
EP-1200932-B1 AUTHENTICATION DEVICE AND METHOD OF AUTHENTICATING PRODUCTS OR PRODUCT PACKAGING SUN CHEMICAL BV (NL) 2006-09-13 EP disclosed
US-7079230-B1 Portable authentication device and method of authenticating products or product packaging SUN CHEMICAL B.V. (NL) 2006-07-18 US disclosed
US-7008533-B2 Macrocyclic antibiotics as separation agents CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2006-03-07 US disclosed
US-20050243305-A1 Tamper-resistant authentication mark for use in product or product packaging authentication VIG RAKESH 2005-11-03 US disclosed
EP-1556822-A1 ON-LINE VERIFICATION OF AN AUTHENTICATION MARK APPLIED TO PRODUCTS OR PRODUCT PACKAGING Sun Chemical B.V. (NL) 2005-07-27 EP disclosed
EP-1549502-A1 AUTHENTICATION MARK FOR A PRODUCT OR PRODUCT PACKAGE Sun Chemical B.V. (NL) 2005-07-06 EP disclosed
EP-1532578-A1 TAMPER-RESISTANT AUTHENTICATION MARK FOR USE IN PRODUCT OR PRODUCT PACKAGING AUTHENTICATION Verification Technologies, Inc. (US) 2005-05-25 EP disclosed
US-20040159610-A1 Macrocyclic antibiotics as separation agents ARMSTRONG DANIEL (US) 2004-08-19 US disclosed
US-5964996-A ELECTROPHORESIS OF FLUID CONTAINING THE ENANTIOMERS WITH A MACROCYCLIC ANTIBIOTIC, WHICH CAUSES SEQUENTIAL SEPARATION OF ENANTIOMERS BY COMPLEXATION, INCLUSION, HYDROGEN BONDING, DIPOLE STACKING OR STERIC INTERACTION CURATORS OF THE UNIVERSITY OF MISSOURI (US) 1999-10-12 US disclosed
US-5874005-A SEPARATION OF ENANTIOMORPHS IN SOLUTION; CHROMATOGRAPHY, ELECTROPHORESIS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 1999-02-23 US disclosed
EP-0748247-A4 MACROCYCLIC ANTIBIOTICS AS SEPARATION AGENTS UNIV MISSOURI (US) 1998-05-06 EP disclosed
US-5626757-A RESOLUTION OF ENANTIOMORPHS BY ELECTROPHORESIS AND CHROMATOGRAPHY ADVANCED SEPARATION TECHNOLOGIES INC. (US) 1997-05-06 US disclosed
EP-0748247-A1 MACROCYCLIC ANTIBIOTICS AS SEPARATION AGENTS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 1996-12-18 EP disclosed
US-5541633-A Ink jet printing of concealed images on carbonless paper XEROX CORPORATION (US) 1996-07-30 US disclosed
WO-1995022390-A1 MACROCYCLIC ANTIBIOTICS AS SEPARATION AGENTS CURATORS OF THE UNIVERSITY OF MISSOURI (US) 1995-08-24 WO disclosed
US-5286286-A Containing diethylene glycol monobutyl ether, glycerol, and a dansyl or porphyrin chromophores XEROX CORPORATION (US) 1994-02-15 US disclosed
EP-0485370-A2 Laser-excitation fluorescence detection electrokinetic separation THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1992-05-13 EP disclosed