SCHEMBL23935955

SCHEMBL23935955

CC1(C)c2ccccc2-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccccc5)cc4)n3)c2C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
TSHR P16473 3/20 0.39
ADORA3 P0DMS8 2/20 0.39
ALOX15 P16050 2/20 0.39
ADORA2A P29274 2/20 0.39
ADORA2B P29275 2/20 0.39
ADORA1 P30542 2/20 0.39
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 4/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
LMNA P02545 5/20 0.35
KDM4E B2RXH2 3/20 0.35
GLA P06280 1/20 0.35
PDK2 Q15119 2/20 0.34
MAPK1 P28482 2/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
NTSR1 P30989 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 0.97 L3MBTL1 (0.43) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL23936655 0.92 L3MBTL1 (0.42) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL23936254 0.91 L3MBTL1 (0.41) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL23936115 0.90 L3MBTL1 (0.40) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL23936653 0.89 ALDH1A1 (0.40) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL23936424 0.88 L3MBTL1 (0.39) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL23935967 0.88 L3MBTL1 (0.39) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL23935969 0.87 L3MBTL1 (0.38) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL23935970 0.87 L3MBTL1 (0.40) L3MBTL1TSHRADORA3ALOX15ADORA2A
SCHEMBL22059309 0.86 L3MBTL1 (0.42) L3MBTL1TSHRADORA3ALOX15ADORA2A

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