SCHEMBL369459

SCHEMBL369459

C=CCNc1ncnc(SCC=C)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2D6 P10635 1/20 0.44
TP53 P04637 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
GAA P10253 4/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 2/20 0.34
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
MTOR P42345 1/20 0.33
HTT P42858 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
SCHEMBL8079391 0.81 KMT2A (0.49) KMT2AMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL8063653 0.81 KMT2A (0.49) KMT2AMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL369672 0.80 MAPT (0.44) KMT2AMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL8074603 0.73 TP53 (0.44) KMT2AMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL727149 0.73 SMN1; SMN2 (0.45) KMT2AMEN1L3MBTL1GAARAB9A
SCHEMBL9279974 0.73 GAA (0.43) KMT2AMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL11787512 0.73 MAPT (0.39) KMT2AMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL5865469 0.73 TP53 (0.50) KMT2AMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL10866329 0.73 MAPT (0.39) KMT2AMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL7741690 0.73 ALDH1A1 (0.50) KMT2AMEN1CYP1A2CYP3A4CYP2C19

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
EP-2407460-B1 N-TRIAZINYLAMMONIUM SALTS, A METHOD OF PREPARATION AND USES THEREOF POLITECHNIKA LODZKA (PL) 2013-07-17 EP disclosed
EP-2407460-A1 N-Triazinylammonium salts, a method of preparation and uses thereof Politechnika Lódzka (PL) 2012-01-18 EP disclosed
US-20100292469-A1 PROCESS FOR THE PREPARATION OF N-TRIAZINYLAMMONIUM SALTS ITALVELLUTI S.P.A. (IT) 2010-11-18 US disclosed
EP-1951691-A1 PROCESS FOR THE PREPARATION OF N-TRIAZINYLAMMONIUM SALTS Italvelluti S.p.A. (IT) 2008-08-06 EP disclosed
WO-2007051496-A1 PROCESS FOR THE PREPARATION OF N-TRIAZINYLAMMONIUM SALTS ITALVELLUTI S.P.A. (IT) 2007-05-10 WO disclosed