SCHEMBL25458183

SCHEMBL25458183

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccc6sc7ccc(-c8ccccc8)cc7c6c5)cc5oc6ccccc6c45)n3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.36
PLA2G4A P47712 4/20 0.36
PIM3 Q86V86 3/20 0.36
LIMK1 P53667 1/20 0.34
ROCK1 Q13464 1/20 0.33
PLA2G10 O15496 1/20 0.32
MAPT P10636 4/20 0.32
TSHR P16473 3/20 0.32
POLB P06746 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
PIM1 P11309 2/20 0.31
PIM2 Q9P1W9 2/20 0.31
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ALOX15 P16050 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 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
SCHEMBL23822233 0.98 PIM3 (0.37) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL25458237 0.98 PIM3 (0.37) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL26589302 0.97 PIM3 (0.35) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL27277982 0.97 PIM3 (0.35) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL25458241 0.96 PIM3 (0.35) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL25458181 0.96 PIM3 (0.35) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL25458175 0.96 PIM3 (0.35) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL23822660 0.95 PIM3 (0.35) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL23822022 0.95 PIM3 (0.36) PLA2G2APLA2G4APIM3LIMK1ROCK1
SCHEMBL23822322 0.94 PIM3 (0.33) PLA2G2APLA2G4APIM3PLA2G10MAPT

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