SCHEMBL13634673

SCHEMBL13634673

N#Cc1ccc(OC2CCN(c3nc(C(=O)Nc4ccncc4C(=O)NC4CCOCC4)co3)CC2)nc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.43
P2RX3 P56373 1/20 0.41
GPR6 P46095 8/20 0.40
IRAK4 Q9NWZ3 5/20 0.39
DPP4 P27487 2/20 0.37
DPP9 Q86TI2 2/20 0.37
DPP8 Q6V1X1 1/20 0.37
PAICS P22234 1/20 0.37

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
SCHEMBL13634791 0.96 PIM1 (0.39) PIM1P2RX3GPR6IRAK4DPP4
SCHEMBL13634778 0.96 PIM1 (0.39) PIM1P2RX3GPR6IRAK4DPP4
SCHEMBL13634546 0.86 GPR6 (0.40) PIM1GPR6DPP4DPP9DPP8
SCHEMBL13634777 0.86 P2RX3 (0.44) P2RX3GPR6
SCHEMBL13634545 0.83 P2RX3 (0.41) P2RX3GPR6
SCHEMBL13634635 0.82 PIM1 (0.45) PIM1GPR6IRAK4
SCHEMBL13162688 0.81 P2RX3 (0.42) P2RX3IRAK4
SCHEMBL13634835 0.79 PIM1 (0.42) PIM1GPR6PAICS
SCHEMBL13634781 0.79 GPR6 (0.40) GPR6IRAK4PAICS
SCHEMBL13634798 0.78 PIM1 (0.48) PIM1GPR6IRAK4PAICS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed