SCHEMBL24749451

SCHEMBL24749451

N#Cc1c(C(F)(F)F)cc(-c2ccc(-c3ccccc3)cc2)cc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.56
ALDH1A1 P00352 6/20 0.56
HPGD P15428 5/20 0.56
GAA P10253 4/20 0.56
GLA P06280 2/20 0.56
L3MBTL1 Q9Y468 4/20 0.52
TDP1 Q9NUW8 2/20 0.52
AR P10275 8/20 0.50
NPSR1 Q6W5P4 1/20 0.47
HTT P42858 2/20 0.47
LMNA P02545 1/20 0.47
PGR P06401 1/20 0.46
KIF11 P52732 2/20 0.45
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL25983810 0.88 KDM4E (0.52) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL5592005 0.82 KDM4E (0.48) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL5592001 0.82 KDM4E (0.48) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL24750269 0.80 AR (0.70) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL25994171 0.79 AR (0.51) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL12679791 0.78 KDM4E (0.53) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL12679792 0.76 KDM4E (0.48) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL4779653 0.74 RXRA (0.58) ARKIF11
SCHEMBL28222645 0.74 RXRA (0.58) ARKIF11
SCHEMBL1906819 0.73 AR (0.43) KDM4EALDH1A1HPGDGAAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4105201-A1 AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING A SUBSTRATE, AN ANODE LAYER AND A CATHODE LAYER, AT LEAST ONE LIGHT EMITTING LAYER, AND AT LEAST ONE SEMICONDUCTOR LAYER THAT COMPRISES AT LEAST ONE METAL COMPOUND OF A METAL AND AT LEAST ONE LIGAND Novaled GmbH (DE) 2022-12-21 EP disclosed