SCHEMBL16483153

SCHEMBL16483153

c1ccc(-c2c3c(c(-c4ccccc4)c4ccccc24)-c2ccc(-c4ccc(-n5c6ccccc6c6cc7cnccc7cc65)cc4)c4cccc-3c24)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HASPIN Q8TF76 6/20 0.44
▸ TNF P01375 1/20 0.39
▸ PIK3CD O00329 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ PIK3CG P48736 1/20 0.38
▸ PIM1 P11309 3/20 0.36
▸ TDO2 P48775 2/20 0.36
▸ IKBKB O14920 5/20 0.35
▸ ALOX5 P09917 1/20 0.34
▸ CLK1 P49759 1/20 0.34
▸ CHUK O15111 3/20 0.33
▸ LCK P06239 1/20 0.33
▸ ROCK1 Q13464 1/20 0.33
▸ TOP2A P11388 1/20 0.32
▸ CCNT1 O60563 1/20 0.32
▸ CDK9 P50750 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ PRKCI P41743 1/20 0.32

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
SCHEMBL16483495 0.91 TNF (0.43) HASPINTNFPIK3CDPIK3CBPIK3CG
SCHEMBL16484905 0.91 TNF (0.40) HASPINTNFPIK3CDPIK3CBPIK3CG
SCHEMBL16483348 0.90 HASPIN (0.41) HASPINTNFPIK3CDPIK3CBPIK3CG
SCHEMBL16483363 0.90 HASPIN (0.41) HASPINTNFPIK3CDPIK3CBPIK3CG
SCHEMBL16484857 0.87 TNF (0.39) TNFALOX5KDM4EATML3MBTL1
SCHEMBL16483422 0.87 TNF (0.42) TNFALOX5KDM4EATML3MBTL1
SCHEMBL16484720 0.85 GFER (0.36) HASPINPIK3CDPIK3CBPIK3CGTDO2
SCHEMBL16484912 0.85 TNF (0.41) TNFALOX5KDM4EATML3MBTL1
SCHEMBL16483454 0.85 TNF (0.44) TNFALOX5KDM4EATML3MBTL1
SCHEMBL16484858 0.84 TNF (0.36) TNFALOX5

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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