SCHEMBL3129362

SCHEMBL3129362

OCCCNCc1nc2ccccc2s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UBE2T Q9NPD8 1/20 0.50
ASIC3 Q9UHC3 1/20 0.50
SMN1; SMN2 Q16637 6/20 0.48
ALOX15 P16050 1/20 0.48
HTT P42858 1/20 0.48
HPGD P15428 5/20 0.46
POLB P06746 1/20 0.46
ATM Q13315 1/20 0.46
RAB9A P51151 5/20 0.46
NPC1 O15118 4/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
ALDH1A1 P00352 2/20 0.46
ILK Q13418 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL3005360 0.84 UBE2T (0.63) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL13539033 0.79 SMN1; SMN2 (0.63) SMN1; SMN2ALOX15HTTHPGDPOLB
SCHEMBL14835424 0.79 SMN1; SMN2 (0.67) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL8424171 0.76 ALOX15 (0.63) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL3250296 0.76 MAPT (0.53) SMN1; SMN2ALOX15HTTHPGDPOLB
SCHEMBL3125957 0.76 SMN1; SMN2 (0.62) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL3919004 0.75 UBE2T (0.61) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL11074021 0.75 NPC1 (0.63) SMN1; SMN2HPGDPOLBRAB9ANPC1
SCHEMBL30007395 0.75 UBE2T (0.66) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL244157 0.75 UBE2T (0.66) UBE2TASIC3SMN1; SMN2ALOX15HTT

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
WO-2010001220-A1 NEW 1,2,4-TRIAZINE DERIVATIVES AND BIOLOGICAL APPLICATIONS THEREOF MUTABILIS SA (FR) 2010-01-07 WO disclosed
WO-2010001220-A1 NEW 1,2,4-TRIAZINE DERIVATIVES AND BIOLOGICAL APPLICATIONS THEREOF MUTABILIS SA (FR) 2010-01-07 WO disclosed
EP-2141164-A1 New 1,2,4-triazine derivatives and biological applications thereof Mutabilis (FR) 2010-01-06 EP disclosed
EP-2141164-A1 New 1,2,4-triazine derivatives and biological applications thereof Mutabilis (FR) 2010-01-06 EP disclosed