SCHEMBL13985266

SCHEMBL13985266

CNc1nc(N(C)C)nc(N(C)C(=O)OC)n1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
GAA P10253 2/20 0.41
ALDH1A1 P00352 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 2/20 0.38
CYP1A2 P05177 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
CREBBP Q92793 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PDE4A P27815 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
HTT P42858 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 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
SCHEMBL13052626 0.95 POLB (0.40) POLBGAAALDH1A1SMN1; SMN2KDM4E
SCHEMBL13052622 0.91 ALDH1A1 (0.42) POLBGAAALDH1A1KDM4ELMNA
SCHEMBL3741120 0.89 POLB (0.48) POLBGAAALDH1A1SMN1; SMN2KDM4E
SCHEMBL13052601 0.84 POLB (0.44) POLBGAAALDH1A1SMN1; SMN2KDM4E
SCHEMBL3641200 0.83 TSHR (0.43) POLBGAAALDH1A1SMN1; SMN2KDM4E
SCHEMBL9988581 0.81 POLB (0.50) POLBGAAALDH1A1SMN1; SMN2KDM4E
Altretamine SCHEMBL4448907 0.79 LMNA (0.61) POLBGAAALDH1A1SMN1; SMN2KDM4E
Pentamethyl Melamine SCHEMBL38832 0.79 LMNA (0.61) POLBGAAALDH1A1SMN1; SMN2KDM4E
SCHEMBL13052608 0.78 ALDH1A1 (0.41) POLBALDH1A1LMNAHTT
SCHEMBL13052621 0.78 POLB (0.40) POLBGAAALDH1A1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2160383-B1 N, N',N''-TRIMETHYL-N, N', N''-TRIS(METHOXYCARBONYL)-MELAMINE DERIVATIVES AND SIMILAR TRIAZINE DERIVATIVES FOR AS CROSS-LINKERS AND/OR BINDERS IN COATING COMPOUNDS, PAINTS, INKS, COMPOSITE MATERIALS AND LAMINATES BOREALIS AGROLINZ MELAMINE (AT) 2016-03-09 EP disclosed
US-8569423-B2 Triazine derivatives and a method for their production BOREALIS AGROLINZ MELAMINE GMBH (AT) 2013-10-29 US disclosed
US-8569423-B2 Triazine derivatives and a method for their production BOREALIS AGROLINZ MELAMINE GMBH (AT) 2013-10-29 US disclosed
WO-2008145704-A1 N, N',N''-TRIMETHYL-N, N', N''-TRIS(METHOXYCARBONYL)-MELAMINE DERIVATIVES AND SIMILAR TRIAZINE DERIVATIVES FOR AS CROSS-LINKERS AND/OR BINDERS IN COATING COMPOUNDS, PAINTS, INKS, COMPOSITE MATERIALS AND LAMINATES BOREALIS AGROLINZ MELAMINE GMBH (AT) 2008-12-04 WO disclosed