SCHEMBL16483100

SCHEMBL16483100

c1ccc2ncc(-c3ccc(-c4ccc5ccc6c(-c7cnc8ccccc8c7)ccc7ccc4c5c76)cc3)cc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 3/20 0.54
▸ PDGFRA P16234 3/20 0.54
▸ CA12 O43570 1/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ PIK3CD O00329 2/20 0.49
▸ PIK3CA P42336 2/20 0.49
▸ TDP2 O95551 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ BIRC5 O15392 1/20 0.47
▸ PIK3CB P42338 1/20 0.46
▸ MTOR P42345 1/20 0.46
▸ PIK3CG P48736 1/20 0.46
▸ PRMT5 O14744 1/20 0.45
▸ WDR77 Q9BQA1 1/20 0.45
▸ ESR2 Q92731 1/20 0.43
▸ MAP4K4 O95819 1/20 0.42
▸ CSNK1G2 P78368 1/20 0.42
▸ CLK4 Q9HAZ1 1/20 0.42

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
SCHEMBL15497847 0.94 PDGFRB (0.54) PDGFRBPDGFRACA12CA1CA2
SCHEMBL17322716 0.91 PDGFRB (0.49) PDGFRBPDGFRACA12CA1CA2
SCHEMBL15497834 0.91 PDGFRB (0.51) PDGFRBPDGFRACA12CA1CA2
SCHEMBL16483458 0.91 PDGFRB (0.51) PDGFRBPDGFRACA12CA1CA2
SCHEMBL16483086 0.91 NPC1 (0.54) PDGFRBPDGFRACA12CA1CA2
SCHEMBL16483088 0.91 NPC1 (0.54) PDGFRBPDGFRACA12CA1CA2
SCHEMBL12269130 0.88 PDGFRB (0.51) PDGFRBPDGFRACA12CA1CA2
SCHEMBL15447012 0.87 PDGFRB (0.53) PDGFRBPDGFRACA12CA1CA2
SCHEMBL16483096 0.87 PRKCZ (0.49) PDGFRBPDGFRACA12CA1CA2
SCHEMBL15891148 0.87 CYP1A2 (0.44) PDGFRBPDGFRACA12CA1CA2

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-2014057873-A1 PHOSPHINE OXIDE DERIVATIVE AND LIGHT-EMITTING ELEMENT PROVIDED WITH SAME 東レ株式会社 (JP) 2014-04-17 — — WO disclosed
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