SCHEMBL3059864

SCHEMBL3059864

S=C(NN=Cc1ccccn1)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.68
RAB9A P51151 5/20 0.68
LMNA P02545 3/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
TOP2A P11388 2/20 0.64
ADORA2A P29274 1/20 0.63
CTH P32929 1/20 0.62
MAPT P10636 4/20 0.58
KDM4E B2RXH2 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
ALDH1A1 P00352 3/20 0.58
MITF O75030 1/20 0.58
ASF1A Q9Y294 1/20 0.58
HKDC1 Q2TB90 1/20 0.57
HTT P42858 2/20 0.56
OPRK1 P41145 2/20 0.56
AGTR1 P30556 2/20 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
SCHEMBL31690655 0.83 TOP2A (0.82) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL13906014 0.81 RAB9A (1.00) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL3067021 0.81 RAB9A (1.00) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL2562207 0.81 TOP2A (0.68) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL293101 0.81 TOP2A (0.68) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL534248 0.81 TOP2A (0.68) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL2562208 0.81 TOP2A (0.68) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL8939918 0.79 RAB9A (0.74) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL8939916 0.79 RAB9A (0.74) NPC1RAB9ALMNASMN1; SMN2MEN1
SCHEMBL13611503 0.78 TOP2A (1.00) NPC1RAB9ALMNASMN1; SMN2MEN1

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 19 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
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