SCHEMBL25458175

SCHEMBL25458175

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccc6c(c5)sc5ccc(-c7ccccc7)cc56)cc5oc6ccccc6c45)n3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.35
PLA2G2A P14555 2/20 0.33
PLA2G4A P47712 2/20 0.33
LIMK1 P53667 2/20 0.32
PIK3CA P42336 1/20 0.31
PI4KA P42356 1/20 0.31
PI4KB Q9UBF8 1/20 0.31
ROCK1 Q13464 1/20 0.31
HCRTR1 O43613 1/20 0.31
MMP12 P39900 1/20 0.30
MMP13 P45452 1/20 0.30
PLA2G10 O15496 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 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
SCHEMBL25458181 1.00 PIM3 (0.35) PIM3PLA2G2APLA2G4ALIMK1PIK3CA
SCHEMBL23822660 0.99 PIM3 (0.35) PIM3PLA2G2APLA2G4ALIMK1PIK3CA
SCHEMBL26763130 0.96 PIM3 (0.35) PIM3PLA2G2APLA2G4ALIMK1PIK3CA
SCHEMBL23822233 0.96 PIM3 (0.37) PIM3PLA2G2APLA2G4ALIMK1ROCK1
SCHEMBL25458237 0.96 PIM3 (0.37) PIM3PLA2G2APLA2G4ALIMK1ROCK1
SCHEMBL23822352 0.96 LIMK1 (0.33) PIM3PLA2G2APLA2G4ALIMK1PIK3CA
SCHEMBL25458236 0.96 LIMK1 (0.33) PIM3PLA2G2APLA2G4ALIMK1PIK3CA
SCHEMBL25458174 0.96 LIMK1 (0.34) PIM3PLA2G2APLA2G4ALIMK1PIK3CA
SCHEMBL25458183 0.96 PLA2G2A (0.36) PIM3PLA2G2APLA2G4ALIMK1PIK3CA
SCHEMBL26227365 0.95 PIM3 (0.34) PIM3PLA2G2APLA2G4ALIMK1LMNA

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