SCHEMBL23328688

SCHEMBL23328688

c1ccc2c(c1)oc1c(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)cccc12

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.37
GPR3 P46089 1/20 0.33
PLA2G2A P14555 4/20 0.33
PLA2G4A P47712 4/20 0.33
TNKS O95271 1/20 0.32
ESR2 Q92731 2/20 0.31
ESR1 P03372 1/20 0.31
PLA2G10 O15496 1/20 0.31
AHR P35869 1/20 0.31
PTPRF P10586 1/20 0.31
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PIM3 Q86V86 1/20 0.30

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
SCHEMBL12283119 0.98 ALOX5 (0.36) ALOX5GPR3PLA2G2APLA2G4ATNKS
SCHEMBL15964418 0.98 PLA2G2A (0.36) ALOX5GPR3PLA2G2APLA2G4ATNKS
SCHEMBL12283874 0.98 ALOX5 (0.36) ALOX5GPR3PLA2G2APLA2G4ATNKS
SCHEMBL15964419 0.98 PLA2G2A (0.36) ALOX5GPR3PLA2G2APLA2G4ATNKS
SCHEMBL12283115 0.98 PLA2G2A (0.36) ALOX5GPR3PLA2G2APLA2G4ATNKS
SCHEMBL23328905 0.98 ALOX5 (0.37) ALOX5GPR3PLA2G2APLA2G4ATNKS
SCHEMBL23867405 0.96 ALOX5 (0.34) ALOX5GPR3PLA2G2APLA2G4AESR2
SCHEMBL17369955 0.94 ALOX5 (0.34) ALOX5PLA2G2APLA2G4APLA2G10PTPRF
SCHEMBL19596036 0.94 PLA2G2A (0.34) ALOX5PLA2G2APLA2G4APLA2G10PTPRF
SCHEMBL23313911 0.94 PLA2G2A (0.34) ALOX5PLA2G2APLA2G4APLA2G10PIM3

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-2021085817-A2 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 랩토 2021-05-06 WO disclosed