SCHEMBL13944161

SCHEMBL13944161

Oc1ccn2ncc(-c3cccc(Cl)c3)c2n1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 13/20 0.59
PIM2 Q9P1W9 9/20 0.59
FLT3 P36888 1/20 0.53
CYBB P04839 2/20 0.50
KDR P35968 1/20 0.50
SLC2A1 P11166 1/20 0.50
HPGD P15428 1/20 0.46
TGFBR2 P37173 1/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL102997 0.86 PIM1 (0.61) PIM1PIM2FLT3CYBBKDR
SCHEMBL13944547 0.83 PIM1 (0.59) PIM1PIM2FLT3CYBBKDR
SCHEMBL13501066 0.83 PIM1 (0.65) PIM1PIM2FLT3MEN1NPC1
SCHEMBL3563380 0.82 CYBB (0.59) PIM1PIM2FLT3CYBBKDR
SCHEMBL13500717 0.81 CYBB (0.61) PIM1PIM2FLT3CYBBSLC2A1
SCHEMBL8207947 0.80 PIM1 (0.61) PIM1PIM2FLT3HPGDTGFBR2
SCHEMBL22421584 0.77 KDR (0.62) PIM1PIM2KDRHPGDMEN1
SCHEMBL18362768 0.77 PIM1 (0.78) PIM1PIM2CYBBSLC2A1HPGD
SCHEMBL13500813 0.77 SLC2A1 (0.70) PIM1PIM2FLT3CYBBSLC2A1
SCHEMBL13501227 0.77 CYBB (0.69) PIM1PIM2FLT3CYBBSLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009017954-A1 INHIBITORS OF JAK2 KINASE PHENOMIX CORPORATION (US) 2009-02-05 WO disclosed