SCHEMBL16483283

SCHEMBL16483283

c1ccc2ncc(-c3ccc4ccc5c(-c6cc(-c7ccncc7)cc(-c7ccncc7)c6)ccc6ccc3c4c65)cc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 8/20 0.62
▸ PDGFRA P16234 8/20 0.62
▸ CYP2A6 P11509 1/20 0.46
▸ PIK3CD O00329 1/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ SLC22A12 Q96S37 1/20 0.41
▸ GAK O14976 1/20 0.40
▸ PARP10 Q53GL7 1/20 0.40
▸ PARP11 Q9NR21 1/20 0.40
▸ EGFR P00533 1/20 0.40
▸ MAPK10 P53779 2/20 0.39
▸ NISCH Q9Y2I1 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ CDK8 P49336 1/20 0.39
▸ CLK2 P49760 1/20 0.39
▸ CDK7 P50613 1/20 0.39

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 0.88 PDGFRB (0.54) PDGFRBPDGFRACYP2A6PIK3CDPIK3CA
SCHEMBL16483281 0.88 CYP2A6 (0.64) PDGFRBPDGFRACYP2A6PIK3CDPIK3CA
SCHEMBL16483100 0.85 PDGFRB (0.54) PDGFRBPDGFRACYP2A6PIK3CDPIK3CA
SCHEMBL15497834 0.85 PDGFRB (0.51) PDGFRBPDGFRACYP2A6PIK3CDPIK3CA
SCHEMBL16483767 0.85 NPC1 (0.50) PDGFRBPDGFRAPIK3CAMAPK10MAP4K4
SCHEMBL16483278 0.85 NPC1 (0.50) PDGFRBPDGFRAPIK3CAMAPK10MAP4K4
SCHEMBL19768482 0.84 PDGFRB (0.49) PDGFRBPDGFRACYP2A6PIK3CDPIK3CA
SCHEMBL16483108 0.84 NPC1 (0.53) PDGFRBPDGFRAPIK3CAMAPK10MAP4K4
SCHEMBL16483258 0.84 PDGFRB (0.43) PDGFRBPDGFRACYP2A6PIK3CDPIK3CA
SCHEMBL17322716 0.82 PDGFRB (0.49) PDGFRBPDGFRACYP2A6PIK3CDPIK3CA

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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