SCHEMBL23936011

SCHEMBL23936011

CC1(C)c2ccccc2-c2ccccc2C1(c1ccc(-c2nc3ccccc3nc2-c2ccccc2)cc1)c1cccc2oc3ccccc3c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.36
KDM4E B2RXH2 6/20 0.35
LMNA P02545 4/20 0.35
ALDH1A1 P00352 4/20 0.35
GAA P10253 2/20 0.35
L3MBTL1 Q9Y468 5/20 0.34
NPSR1 Q6W5P4 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
AKT1 P31749 1/20 0.33
AKT2 P31751 1/20 0.33
MAPT P10636 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
DHODH Q02127 1/20 0.31
USP2 O75604 1/20 0.31
HPGD P15428 1/20 0.31
CYP1A2 P05177 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 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
SCHEMBL23936753 0.90 MEN1 (0.42) KDM4ELMNAALDH1A1KMT2AMEN1
SCHEMBL23936666 0.88 TSHR (0.32) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL23936608 0.82 TDP1 (0.47) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL23936613 0.80 TSHR (0.31) TDP1KDM4ELMNAALDH1A1L3MBTL1
SCHEMBL23936476 0.79
SCHEMBL23936757 0.79 TDP1 (0.36) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL23920326 0.77 L3MBTL1 (0.46) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL23936617 0.76 KDM4E (0.42) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL23384925 0.76 L3MBTL1 (0.45) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL23385022 0.76 L3MBTL1 (0.49) TDP1KDM4ELMNAALDH1A1GAA

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
US-20210328150-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 US disclosed