SCHEMBL16483400

SCHEMBL16483400

c1ccc2c(c1)-c1cccc3c(-c4ccc(-n5c6ccccc6c6ccc7cnccc7c65)cc4)ccc-2c13

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNF P01375 2/20 0.36
▸ DUSP3 P51452 1/20 0.34
▸ CDK4 P11802 1/20 0.33
▸ CCND1 P24385 1/20 0.33
▸ MAPK14 Q16539 1/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ PIK3CB P42338 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ DYRK1A Q13627 1/20 0.32
▸ CYP17A1 P05093 2/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ TLR8 Q9NR97 1/20 0.32
▸ TLR7 Q9NYK1 1/20 0.32
▸ IKBKE Q14164 1/20 0.31
▸ TBK1 Q9UHD2 1/20 0.31
▸ KDR P35968 1/20 0.31
▸ TDO2 P48775 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL16483406 0.91 TNF (0.41) TNFCDK4PIK3CDPIK3CBPIK3CG
SCHEMBL16483317 0.91 TNF (0.44) TNFDUSP3MAPK14PIK3CDPIK3CB
SCHEMBL16483167 0.90 TNF (0.37) TNFDUSP3CDK4CCND1MAPK14
SCHEMBL16483859 0.90 TNF (0.37) TNFCDK4CCND1PIK3CDPIK3CB
SCHEMBL16483593 0.89 TNF (0.34) TNFDUSP3CDK4CCND1MAPK14
SCHEMBL16483407 0.89 TNF (0.44) TNFMAPK14KDM4EL3MBTL1CYP11B1
SCHEMBL16483567 0.89 TNF (0.35) TNFCDK4CCND1PIK3CDPIK3CB
SCHEMBL16483146 0.89 NTSR1 (0.36) TNFCDK4CCND1PIK3CDPIK3CB
SCHEMBL17341240 0.87 L3MBTL1 (0.36) TNFDUSP3MAPK14KDM4EATM
SCHEMBL16483819 0.86 DUSP3 (0.35) TNFDUSP3CDK4CCND1MAPK14

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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