SCHEMBL3070050

SCHEMBL3070050

N=C(NC(=N)Oc1cccc2ccccc12)Oc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
HSD17B10 Q99714 4/20 0.56
MAPK1 P28482 2/20 0.56
PGR P06401 1/20 0.56
GAA P10253 1/20 0.56
PTGS1 P23219 1/20 0.56
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CYP1A2 P05177 4/20 0.46
KDM4E B2RXH2 3/20 0.46
CYP2C19 P33261 1/20 0.46
NR2E1 Q9Y466 4/20 0.45
HPGD P15428 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MMP2 P08253 1/20 0.44
HTR1B P28222 4/20 0.44
HTR1D P28221 2/20 0.44
OGG1 O15527 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
SCHEMBL3079119 0.86 ALDH1A1 (0.55) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL15014012 0.78 HSD17B10 (0.53) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL11316962 0.76 ALDH1A1 (0.55) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL1043115 0.76 ALDH1A1 (0.61) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL37865 0.75 ALDH1A1 (0.65) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL8540307 0.75 ALDH1A1 (0.59) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL6884394 0.75 ALDH1A1 (0.55) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL6160141 0.75 HSD17B10 (0.55) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL7181428 0.75 ALDH1A1 (0.65) ALDH1A1HSD17B10MAPK1PGRGAA
SCHEMBL29901836 0.75 ALDH1A1 (0.65) ALDH1A1HSD17B10MAPK1PGRGAA

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 17 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
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed