SCHEMBL3083797

SCHEMBL3083797

O=C(CC(S)c1ccco1)c1ccco1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 8/20 0.50
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
AGTR1 P30556 1/20 0.50
ALDH1A1 P00352 10/20 0.49
MAPT P10636 6/20 0.49
HSD17B10 Q99714 6/20 0.49
L3MBTL1 Q9Y468 5/20 0.49
HPGD P15428 5/20 0.49
TDP1 Q9NUW8 4/20 0.49
RECQL P46063 3/20 0.49
ALOX15 P16050 3/20 0.49
ERCC5 P28715 1/20 0.49
FEN1 P39748 1/20 0.49
MIF P14174 1/20 0.47
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
TSHR P16473 3/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 2/20 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
SCHEMBL3082332 0.81 POLB (0.56) POLBKMT2AMEN1AGTR1ALDH1A1
SCHEMBL11854703 0.80 MIF (0.56) POLBKMT2AMEN1AGTR1ALDH1A1
SCHEMBL3074374 0.79 POLB (0.42) POLBKMT2AMEN1AGTR1ALDH1A1
SCHEMBL14073806 0.77 ALDH1A1 (0.56) POLBKMT2AMEN1AGTR1ALDH1A1
SCHEMBL28744506 0.74 ALDH1A1 (0.50) POLBKMT2AMEN1AGTR1ALDH1A1
SCHEMBL10972732 0.74 POLB (0.50) POLBKMT2AMEN1AGTR1ALDH1A1
SCHEMBL27564320 0.74 ERCC5 (0.54) POLBKMT2AMEN1AGTR1ALDH1A1
SCHEMBL29005627 0.74 ALDH1A1 (0.50) POLBKMT2AMEN1AGTR1ALDH1A1
SCHEMBL5805288 0.74
SCHEMBL6320074 0.73 ERCC5 (0.74) POLBKMT2AMEN1ALDH1A1MAPT

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-7235142-B2 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON (US) 2007-06-26 US disclosed
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
US-20040104377-A1 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON 2004-06-03 US disclosed
US-20040020568-A1 Non-toxic corrosion-protection conversion coats based on rare earth elements DAYTON, UNIVERSITY OF 2004-02-05 US disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 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