SCHEMBL968327

SCHEMBL968327

OCCOc1cccc(-c2nc(-c3ccc(Cl)cc3)nc(-c3cccc(OCCO)c3O)n2)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHPS P49366 4/20 0.46
MAOB P27338 1/20 0.44
FABP4 P15090 4/20 0.37
FABP3 P05413 2/20 0.37
ALPL P05186 1/20 0.37
ALPI P09923 1/20 0.37
ALPG P10696 1/20 0.37
PDE5A O76074 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.35
NOTUM Q6P988 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C8 P10632 1/20 0.35
CYP2C9 P11712 1/20 0.35
DHODH Q02127 1/20 0.35
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
LTB4R Q15722 1/20 0.35

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
SCHEMBL968043 0.86 DHPS (0.46) DHPSFABP4FABP3PDE5AMEN1
SCHEMBL8651030 0.85 DHPS (0.48) DHPSMAOBFABP4FABP3PDE5A
SCHEMBL4581724 0.75 MAPK1 (0.51) DHPSMAOBPDE5AMEN1KMT2A
SCHEMBL6054722 0.74 PTPN11 (0.46) PDE5AMEN1KMT2AMAPTCYP3A4
SCHEMBL8094936 0.74 MCHR1 (0.41) DHPSFABP4PDE5AMEN1KMT2A
SCHEMBL626750 0.74 KMT2A (0.51) DHPSMEN1KMT2AMAPTCYP3A4
SCHEMBL29354712 0.74 KMT2A (0.51) DHPSMEN1KMT2AMAPTCYP3A4
SCHEMBL8918201 0.73 MAPK1 (0.46) DHPSMAOBPDE5AMEN1KMT2A
SCHEMBL4744929 0.73 TP53 (0.51) MEN1KMT2A
SCHEMBL8651033 0.73 MAPT (0.48) DHPSMEN1KMT2AMAPTNOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7867294-B2 Triazine compounds for removing acids and water from nonaqueous electrolytes for electrochemical cells NOVOLYTE TECHNOLOGIES INC. (US) 2011-01-11 US claimed
US-20100192363-A1 Triazine Compounds For Removing Acids And Water From Nonaqueous Electrolytes For Electrochemical Cells FERRO CORPORATION (US) 2010-08-05 US claimed
US-7727669-B2 Triazine compounds for removing acids and water from nonaqueous electrolytes for electrochemical cells NOVOLYTE TECHNOLOGIES INC. (US) 2010-06-01 US claimed
US-20060269844-A1 Triazine compounds for removing acids and water from nonaqueous electrolytes for electrochemical cells FERRO CORPORATION (US) 2006-11-30 US claimed
US-7867294-B2 Triazine compounds for removing acids and water from nonaqueous electrolytes for electrochemical cells NOVOLYTE TECHNOLOGIES INC. (US) 2011-01-11 US disclosed
US-20100192363-A1 Triazine Compounds For Removing Acids And Water From Nonaqueous Electrolytes For Electrochemical Cells FERRO CORPORATION (US) 2010-08-05 US disclosed
US-7727669-B2 Triazine compounds for removing acids and water from nonaqueous electrolytes for electrochemical cells NOVOLYTE TECHNOLOGIES INC. (US) 2010-06-01 US disclosed
EP-1765878-A1 PROCESS FOR PHOTOCURING WITH LIGHT EMITTING DIODES CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-03-28 EP disclosed
US-20060269844-A1 Triazine compounds for removing acids and water from nonaqueous electrolytes for electrochemical cells FERRO CORPORATION (US) 2006-11-30 US disclosed
WO-2005100408-A1 PROCESS FOR PHOTOCURING WITH LIGHT EMITTING DIODES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-10-27 WO disclosed