SCHEMBL23936655

SCHEMBL23936655

CC1(C)c2ccccc2-c2cccc(-c3ccccc3-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2C1(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
TSHR P16473 3/20 0.40
ADORA2A P29274 3/20 0.40
ADORA1 P30542 3/20 0.40
ADORA3 P0DMS8 2/20 0.40
ADORA2B P29275 2/20 0.40
ALOX15 P16050 2/20 0.40
POLB P06746 1/20 0.34
LMNA P02545 4/20 0.34
MAPK1 P28482 3/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
HPGD P15428 3/20 0.33
KDM4E B2RXH2 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33

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
SCHEMBL23936687 0.95 L3MBTL1 (0.43) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23935955 0.92 L3MBTL1 (0.41) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23936254 0.92 L3MBTL1 (0.41) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23935969 0.91 L3MBTL1 (0.38) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23936115 0.91 L3MBTL1 (0.40) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23936190 0.90 L3MBTL1 (0.39) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23935967 0.90 L3MBTL1 (0.39) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23936424 0.90 L3MBTL1 (0.39) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23935970 0.88 L3MBTL1 (0.40) L3MBTL1TSHRADORA2AADORA1ADORA3
SCHEMBL23936182 0.86 L3MBTL1 (0.41) L3MBTL1TSHRADORA2AADORA1ADORA3

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