SCHEMBL28594941

SCHEMBL28594941

OB(O)c1cccc(-c2cc(-c3cccc4c3oc3ccccc34)cc(-c3ccccc3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.47
▸ MGLL Q99685 1/20 0.42
▸ GGPS1 O95749 1/20 0.41
▸ PTGES2 Q9H7Z7 1/20 0.39
▸ PLG P00747 1/20 0.35
▸ F12 P00748 1/20 0.35
▸ F11 P03951 1/20 0.35
▸ KLKB1 P03952 1/20 0.35
▸ PRSS1 P07477 1/20 0.35
▸ PRSS2 P07478 1/20 0.35
▸ PRSS3 P35030 1/20 0.35
▸ PRKDC P78527 5/20 0.35
▸ PIK3CD O00329 1/20 0.35
▸ PIK3CB P42338 1/20 0.35
▸ ATM Q13315 1/20 0.34
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL30980094 0.86 ALOX5 (0.61) ALOX5MGLLGGPS1PTGES2PLG
SCHEMBL283154 0.86 ALOX5 (0.61) ALOX5MGLLGGPS1PTGES2PLG
SCHEMBL12996516 0.85 ALOX5 (0.52) ALOX5GGPS1PTGES2PRKDCPIK3CD
SCHEMBL21102243 0.82 ALOX5 (0.58) ALOX5MGLLGGPS1PTGES2PRKDC
SCHEMBL15501806 0.81 ALOX5 (0.55) ALOX5GGPS1PTGES2PRKDCPIK3CD
SCHEMBL12996564 0.81 ALOX5 (0.51) ALOX5GGPS1PTGES2PRKDCPIK3CD
SCHEMBL15501713 0.81 ALOX5 (0.55) ALOX5GGPS1PTGES2PRKDCPIK3CD
SCHEMBL16573884 0.81 ALOX5 (0.55) ALOX5GGPS1PTGES2PRKDCPIK3CD
SCHEMBL28599546 0.81 ALOX5 (0.46) ALOX5GGPS1PTGES2PRKDCPIK3CD
SCHEMBL16405828 0.80 ALOX5 (0.53) ALOX5GGPS1PTGES2PRKDCPIK3CD

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
CN-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 — — CN disclosed
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