SCHEMBL25459302

SCHEMBL25459302

c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)oc2cc(-c4ccc5c(c4)oc4cccc(-c6cccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6)c45)ccc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.33
ALK Q9UM73 1/20 0.31
HCRTR1 O43613 1/20 0.31
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31
PLA2G10 O15496 1/20 0.30
PLA2G2A P14555 1/20 0.30
PLA2G4A P47712 1/20 0.30
PRKDC P78527 1/20 0.30
TSPO P30536 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
SCHEMBL23823785 0.99 PTGER4 (0.33) PTGER4HCRTR1MMP12MMP13PRKDC
SCHEMBL25459314 0.99 ALK (0.32) PTGER4ALKHCRTR1PLA2G10PLA2G2A
SCHEMBL25926902 0.99 PTGER4 (0.33) PTGER4HCRTR1MMP12MMP13PRKDC
SCHEMBL21666832 0.98 ALK (0.32) PTGER4ALKPLA2G10PLA2G2APLA2G4A
SCHEMBL25459322 0.97 PTGER4 (0.33) PTGER4ALKHCRTR1MMP12MMP13
SCHEMBL25458801 0.97 PTGER4 (0.33) PTGER4ALKHCRTR1MMP12MMP13
SCHEMBL25459339 0.97 PTGER4 (0.33) PTGER4ALKHCRTR1MMP12MMP13
SCHEMBL25459499 0.96 PTGER4 (0.34) PTGER4ALKHCRTR1MMP12MMP13
SCHEMBL25458753 0.96 PTGER4 (0.34) PTGER4HCRTR1MMP12MMP13PLA2G10
SCHEMBL25458795 0.96 PTGER4 (0.34) PTGER4HCRTR1MMP12MMP13PLA2G10

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