SCHEMBL6920873

SCHEMBL6920873

CCCCNc1nc(Cl)nc(NC2CCCC2)n1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.59
KMT2A Q03164 2/20 0.56
RAB9A P51151 1/20 0.49
MERTK Q12866 6/20 0.44
FLT3 P36888 5/20 0.44
TYRO3 Q06418 5/20 0.44
GAS6 Q14393 5/20 0.44
LMNA P02545 1/20 0.43
AXL P30530 1/20 0.42
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41

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
SCHEMBL9913708 0.91 MERTK (0.50) PDE4AMERTKFLT3TYRO3GAS6
SCHEMBL10345298 0.86 KMT2A (0.49) PDE4AKMT2AMERTKFLT3TYRO3
SCHEMBL11198498 0.84 PDE4A (0.66) PDE4AKMT2ARAB9ALMNA
SCHEMBL14725039 0.84 TLR7 (0.46) PDE4AKMT2ARAB9AMERTKFLT3
SCHEMBL6679846 0.83 PDE4A (0.69) PDE4AKMT2ARAB9ALMNACTSS
SCHEMBL2783761 0.82 KMT2A (0.71) KMT2ALMNA
SCHEMBL6677011 0.81 LMNA (0.63) PDE4AKMT2ARAB9ALMNA
SCHEMBL20694824 0.81 KMT2A (0.81) KMT2ALMNA
SCHEMBL14522578 0.80 NPSR1 (0.44) PDE4AKMT2AMERTKFLT3TYRO3
SCHEMBL20814607 0.79 PDE4A (0.55) PDE4AKMT2ARAB9A

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-2002036578-A9 TRIAZINE DERIVATIVES AS LPAAT-B INHIBITORS AND USES THEREOF BONHAM LYNN (US) 2004-04-22 WO claimed
WO-2002036578-A2 TRIAZINE DERIVATIVES AS LPAAT-B INHIBITORS AND USES THEREOF BONHAM LYNN (US) 2002-05-10 WO claimed
WO-2002036578-A9 TRIAZINE DERIVATIVES AS LPAAT-B INHIBITORS AND USES THEREOF BONHAM LYNN (US) 2004-04-22 WO disclosed
WO-2002036578-A2 TRIAZINE DERIVATIVES AS LPAAT-B INHIBITORS AND USES THEREOF BONHAM LYNN (US) 2002-05-10 WO disclosed