SCHEMBL25459339

SCHEMBL25459339

c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)oc2ccc(-c4cccc(-c5ccc6c(c5)oc5cccc(-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7)c56)c4)cc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.33
PLA2G2A P14555 3/20 0.33
PLA2G4A P47712 3/20 0.33
PLA2G10 O15496 1/20 0.33
PIM1 P11309 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
CHEK2 O96017 1/20 0.32
HCRTR1 O43613 1/20 0.31
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31
PRKDC P78527 2/20 0.31
BACE1 P56817 1/20 0.30
ALK Q9UM73 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
SCHEMBL25458801 1.00 PTGER4 (0.33) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25459322 1.00 PTGER4 (0.33) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25458753 0.99 PTGER4 (0.34) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25458795 0.99 PTGER4 (0.34) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25459303 0.98 PLA2G2A (0.33) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25459340 0.97 PLA2G2A (0.33) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25459323 0.97 PLA2G2A (0.33) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25459499 0.97 PTGER4 (0.34) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25459521 0.97 PTGER4 (0.34) PTGER4PLA2G2APLA2G4APLA2G10PIM1
SCHEMBL25459302 0.97 PTGER4 (0.33) PTGER4PLA2G2APLA2G4APLA2G10HCRTR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 US disclosed
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 US disclosed