SCHEMBL24293290

SCHEMBL24293290

CC1(C)c2ccccc2C2(c3ccccc3-c3c(N4c5ccccc5Sc5ccccc54)cccc32)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.38
NOX1 Q9Y5S8 2/20 0.33
PGR P06401 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.32
BCHE P06276 8/20 0.32
HPGD P15428 1/20 0.31
PTGS1 P23219 2/20 0.31
PTGS2 P35354 2/20 0.31
ACHE P22303 2/20 0.31
KDM1A O60341 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
CHRM3 P20309 1/20 0.31
SLC6A2 P23975 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 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
SCHEMBL24648264 0.91 MAOA (0.38) MAOANOX1MEN1KMT2AALDH1A1
SCHEMBL19759960 0.84 KDM4E (0.32) MAOAMEN1KMT2ABCHE
SCHEMBL17974877 0.84 PGR (0.36) PGRMEN1KMT2AALDH1A1
SCHEMBL21867486 0.84 HDAC6 (0.37) MAOAPGRALDH1A1BCHEHPGD
SCHEMBL21868552 0.83 PGR (0.34) MAOAPGRHDAC6
SCHEMBL23278289 0.82 HDAC6 (0.36) MAOAHDAC6
SCHEMBL21867498 0.80 DUSP3 (0.33) BCHE
SCHEMBL19001824 0.80 PDK2 (0.39) BCHE
SCHEMBL21868330 0.79
SCHEMBL24646443 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 US disclosed
US-20220123218-A1 ORGANIC ELECTROLUMINESCENT DEVICE LG CHEM, LTD. (KR) 2022-04-21 US disclosed