SCHEMBL12489685

SCHEMBL12489685

c1ccc(-c2ccc3c4ccc(-c5cccc(-c6ccc7c(c6)Sc6ccccc6O7)c5)cc4c4ccccc4c3c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.35
PLA2G4A P47712 4/20 0.35
PLA2G10 O15496 1/20 0.35
GPR84 Q9NQS5 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
PRKDC P78527 1/20 0.32
MAP4K4 O95819 1/20 0.31
PTPN2 P17706 1/20 0.31
PTPN1 P18031 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
SCHEMBL12489816 0.97 PLA2G2A (0.34) PLA2G2APLA2G4APLA2G10GPR84CA12
SCHEMBL12490399 0.97 PLA2G2A (0.34) PLA2G2APLA2G4APLA2G10PRKDC
SCHEMBL12488555 0.97 PLA2G2A (0.35) PLA2G2APLA2G4APLA2G10GPR84CA12
SCHEMBL18961039 0.94 PLA2G2A (0.31) PLA2G2APLA2G4AGPR84PRKDC
SCHEMBL12489575 0.93 PLA2G2A (0.33) PLA2G2APLA2G4AGPR84CA12CA9
SCHEMBL12489686 0.90 MEN1 (0.36) PLA2G2APLA2G4AGPR84KDM4EMEN1
SCHEMBL18961022 0.89 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10GPR84CA12
SCHEMBL12488504 0.89 CA12 (0.33) PLA2G2APLA2G4APLA2G10CA12CA9
SCHEMBL12489878 0.89 PLA2G2A (0.34) PLA2G2APLA2G4APLA2G10GPR84CA12
SCHEMBL12490366 0.88 PLA2G2A (0.34) PLA2G2APLA2G4APLA2G10PRKDC

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-2011081451-A2 TRI-PHENYL COMPOUNDS AND ORGANIC ELECTRO-LUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2011-07-07 WO disclosed