SCHEMBL2844607

SCHEMBL2844607

CN(CCO)c1nc(N)nc(N(C)CCO)n1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
SLC29A1 Q99808 4/20 0.41
KDM4E B2RXH2 1/20 0.38
PTPN1 P18031 1/20 0.37
POLB P06746 1/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
KDR P35968 1/20 0.35
JAK3 P52333 1/20 0.35
AURKB Q96GD4 1/20 0.35
SLC9A5 Q14940 1/20 0.35
MAPT P10636 2/20 0.35
MAP4K4 O95819 2/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL15789176 0.96 SLC29A1 (0.41) CA12CA1CA2CA9SLC29A1
SCHEMBL1033204 0.92 SLC29A1 (0.53) CA12CA1CA2CA9SLC29A1
SCHEMBL1031875 0.89 CA12 (0.46) CA12CA1CA2CA9SLC29A1
SCHEMBL11772001 0.82 LMNA (0.52) CA12CA1CA2CA9SLC29A1
SCHEMBL11764977 0.82 LMNA (0.52) CA12CA1CA2CA9SLC29A1
SCHEMBL13873109 0.81 HRH3 (0.39) MAPTTSHR
SCHEMBL11765891 0.80 CA12 (0.42) CA12CA1CA2CA9SLC29A1
SCHEMBL11768860 0.80 CA12 (0.42) CA12CA1CA2CA9SLC29A1
SCHEMBL2844610 0.79 CA12 (0.35) CA12CA1CA2CA9SLC29A1
SCHEMBL11769020 0.78 CA12 (0.49) CA12CA1CA2CA9SLC29A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010066686-A2 NOVEL TRIAZINE POLYMERS, METHOD FOR THE PRODUCTION AND USE THEREOF BOREALIS AGROLINZ MELAMINE GMBH (AT) 2010-06-17 WO claimed
EP-2743262-B1 Method for Obtaining a Triazine Compound with at least one Tertiary Amino Group BOREALIS AGROLINZ MELAMINE (AT) 2016-04-27 EP disclosed
EP-2743262-A1 Method for Obtaining a Triazine Compound with at least one Tertiary Amino Group Borealis Agrolinz Melamine GmbH (AT) 2014-06-18 EP disclosed
WO-2010066686-A2 NOVEL TRIAZINE POLYMERS, METHOD FOR THE PRODUCTION AND USE THEREOF BOREALIS AGROLINZ MELAMINE GMBH (AT) 2010-06-17 WO disclosed
US-3981829-A CATALYST SYSTEM OF ALKANOLAMINOTRIAZINE, HEXAHYDROTRIAZINE, A PHENOL BASF WYANDOTTE CORPORATION (US) 1976-09-21 US disclosed