SCHEMBL25458241

SCHEMBL25458241

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5cccc(-c6ccc7sc8ccccc8c7c6)c5)cc5oc6ccccc6c45)n3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.35
PLA2G2A P14555 3/20 0.34
PLA2G4A P47712 3/20 0.34
PLA2G10 O15496 1/20 0.34
LIMK1 P53667 1/20 0.32
ROCK1 Q13464 1/20 0.31
CYP1A2 P05177 1/20 0.31
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
SCHEMBL23822022 0.99 PIM3 (0.36) PIM3PLA2G2APLA2G4APLA2G10LIMK1
SCHEMBL25458237 0.98 PIM3 (0.37) PIM3PLA2G2APLA2G4APLA2G10LIMK1
SCHEMBL23822233 0.98 PIM3 (0.37) PIM3PLA2G2APLA2G4APLA2G10LIMK1
SCHEMBL26589302 0.97 PIM3 (0.35) PIM3PLA2G2APLA2G4ALIMK1ROCK1
SCHEMBL27277982 0.97 PIM3 (0.35) PIM3PLA2G2APLA2G4ALIMK1ROCK1
SCHEMBL23822032 0.96 PIM3 (0.33) PIM3PLA2G2APLA2G4APLA2G10CYP1A2
SCHEMBL25458183 0.96 PLA2G2A (0.36) PIM3PLA2G2APLA2G4APLA2G10LIMK1
SCHEMBL23822660 0.95 PIM3 (0.35) PIM3PLA2G2APLA2G4ALIMK1ROCK1
SCHEMBL23822322 0.94 PIM3 (0.33) PIM3PLA2G2APLA2G4APLA2G10CYP1A2
SCHEMBL25458239 0.94 PLA2G2A (0.34) PIM3PLA2G2APLA2G4APLA2G10LIMK1

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