SCHEMBL3083065

SCHEMBL3083065

NC(=O)NC(=S)Nc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.67
ALDH1A1 P00352 8/20 0.63
TAS2R38 P59533 2/20 0.63
HSD17B10 Q99714 2/20 0.63
TP53 P04637 1/20 0.63
TYR P14679 1/20 0.63
TSHR P16473 1/20 0.63
CYP3A4 P08684 1/20 0.61
GAA P10253 8/20 0.58
LMNA P02545 2/20 0.58
RAB9A P51151 6/20 0.57
NPC1 O15118 5/20 0.57
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57
NOX1 Q9Y5S8 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
KDM4E B2RXH2 1/20 0.56
PPARG P37231 1/20 0.55
NCOA2 Q15596 1/20 0.55
NCOA1 Q15788 1/20 0.55

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
SCHEMBL4754194 0.84 GAA (0.76) ALDH1A1TAS2R38HSD17B10TP53TYR
SCHEMBL23728134 0.83 EPHX1 (0.71) EPHX1ALDH1A1TAS2R38HSD17B10TP53
SCHEMBL2316198 0.83 ALDH1A1 (0.75) EPHX1ALDH1A1TAS2R38HSD17B10TP53
SCHEMBL730314 0.83 ALDH1A1 (0.80) EPHX1ALDH1A1TAS2R38HSD17B10TP53
SCHEMBL29484170 0.81 EPHX1 (0.69) EPHX1ALDH1A1GAALMNARAB9A
SCHEMBL11634169 0.81 ALDH1A1 (0.66) ALDH1A1GAALMNARAB9ANPC1
Thiourea SCHEMBL21055683 0.81 ALDH1A1 (0.85) ALDH1A1TAS2R38HSD17B10TP53TYR
N-(Phenylcarbamothioyl)Acetamide SCHEMBL5458065 0.80 EPHX1 (1.00) EPHX1ALDH1A1TAS2R38HSD17B10CYP3A4
SCHEMBL3421577 0.80 ALDH1A1 (0.63) EPHX1ALDH1A1TAS2R38HSD17B10TP53
SCHEMBL3071721 0.79 SMN1; SMN2 (0.67) EPHX1ALDH1A1TP53TSHRGAA

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 21 patents — showing the first 20. 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
EP-1472319-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2004-11-03 EP 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
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED 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-4229462-A N-ARYL-N'-(2-IMIDAZOLIDINYLIDENE)UREA MCNEILAB, INC. (US) 1980-10-21 US disclosed