SCHEMBL30323720

SCHEMBL30323720

c1cc(-c2cnc3ccccc3c2)cc(-c2cnc3ccccc3c2)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.77
CYP2A6 P11509 1/20 0.68
PDGFRB P09619 5/20 0.67
PDGFRA P16234 5/20 0.67
MAP4K4 O95819 1/20 0.66
CSNK1G2 P78368 1/20 0.66
CLK4 Q9HAZ1 1/20 0.66
MKNK2 Q9HBH9 1/20 0.66
MAP4K5 Q9Y4K4 1/20 0.66
PIK3CD O00329 2/20 0.64
PIK3CA P42336 2/20 0.64
PIK3CB P42338 1/20 0.58
MTOR P42345 1/20 0.58
PIK3CG P48736 1/20 0.58
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54

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
SCHEMBL27631118 1.00 BIRC5 (0.77) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL2772360 0.91 PDGFRB (0.77) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL32667946 0.91 PDGFRB (0.77) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL19467303 0.91 BIRC5 (0.66) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL18327501 0.91 BIRC5 (0.66) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL18079845 0.91 BIRC5 (0.66) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL12074709 0.90 PDGFRB (0.70) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL708999 0.89 PDGFRB (0.75) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL17854717 0.88 BIRC5 (0.62) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4
SCHEMBL18327638 0.88 BIRC5 (0.62) BIRC5CYP2A6PDGFRBPDGFRAMAP4K4

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-2023048118-A1 COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT 保土谷化学工業株式会社 2023-03-30 WO disclosed