SCHEMBL3077375

SCHEMBL3077375

NC(=O)c1ccccc1Sc1ccccc1C(N)=O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.77
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 3/20 0.54
MAPT P10636 3/20 0.54
TSHR P16473 2/20 0.54
HSD17B10 Q99714 2/20 0.54
HPGD P15428 1/20 0.54
METAP2 P50579 1/20 0.50
BCAT2 O15382 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
POLB P06746 2/20 0.46
GAA P10253 1/20 0.44
CTNNB1 P35222 1/20 0.44
RAB9A P51151 2/20 0.42
NPC1 O15118 2/20 0.42
IRAK4 Q9NWZ3 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
CYP3A4 P08684 1/20 0.42
PARP1 P09874 1/20 0.42

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
SCHEMBL6632850 0.90 SIRT1 (0.65) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL6634883 0.90 SIRT1 (0.65) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL6629741 0.90 SIRT1 (0.65) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL1030659 0.87 SIRT1 (1.00) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL1399456 0.86 SIRT1 (0.64) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL11821622 0.86 SIRT1 (0.64) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL29530768 0.86 SIRT1 (0.64) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL6746282 0.84 SIRT1 (0.62) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL7707370 0.84 MAPT (0.66) SIRT1KDM4EALDH1A1MAPTTSHR
SCHEMBL6630665 0.82 SIRT1 (0.77) SIRT1KDM4EALDH1A1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480977-A2 SUBSTITUTED ARYL COMPOUNDS FOR TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-12-01 EP claimed
WO-2003070728-A2 AZABICYCLO-SUBSTITUTED BENZOYLAMIDES AND THIOAMIDES FOR TREATMENT OF CNS-RELATED DISORDERS PHARMACIA & UPJOHN COMPANY (US) 2003-08-28 WO claimed
WO-1997027746-A1 WHITEFLY INSECTICIDE TARGOSZ EUGENE F (US) 1997-08-07 WO claimed
US-7833331-B2 Non-toxic corrosion-protection pigments based on cobalt UNIVERSITY OF DAYTON (US) 2010-11-16 US disclosed
US-7789958-B2 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON (US) 2010-09-07 US disclosed
US-20090163628-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON COBALT STURGILL JEFFREY ALLEN 2009-06-25 US disclosed
US-7422793-B2 Non-toxic corrosion-protection rinses and seals based on rare earth elements UNIVERSITY OF DAYTON (US) 2008-09-09 US disclosed
US-7407711-B2 Non-toxic corrosion-protection conversion coats based on rare earth elements UNIVERSITY OF DAYTON (US) 2008-08-05 US disclosed
US-7294211-B2 Non-toxic corrosion-protection conversion coats based on cobalt UNIVERSITY OF DAYTON (US) 2007-11-13 US disclosed
US-7291217-B2 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON (US) 2007-11-06 US disclosed
US-20070149673-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE STURGILL JEFFREY A 2007-06-28 US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 US disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
US-5658954-A NONTOXIC TO HUMAN, ANIMALS; MIXTURE OF COTTONSEED OIL AMIDE, COCONUT OIL AMIDE, TALL OIL AMIDE, NONIONIC SURFACTANT, CHELATE COMPOUND AND FLOW CONTROL AGENT TARGOSZ EUGENE F (US) 1997-08-19 US disclosed
WO-1997027746-A1 WHITEFLY INSECTICIDE TARGOSZ EUGENE F (US) 1997-08-07 WO disclosed
US-5496857-A ALKANOL AMIDES OF COTTONSEED, COCONUT AND TALL OIL, NONIONIC SURFACTANTS TARGOSZ EUGENE F (US) 1996-03-05 US disclosed