SCHEMBL23936128

SCHEMBL23936128

CC1(C)c2ccccc2-c2c(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cccc2C1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
ADORA2A P29274 3/20 0.38
ADORA1 P30542 3/20 0.38
ADORA3 P0DMS8 2/20 0.38
ADORA2B P29275 2/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
POLB P06746 1/20 0.36
PDK2 Q15119 5/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.35
LMNA P02545 3/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 2/20 0.34
GLA P06280 1/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 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
SCHEMBL23936684 0.94 ADORA2A (0.39) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL23936411 0.94 L3MBTL1 (0.38) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL23936193 0.91 PDK2 (0.38) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL23936715 0.91 MEN1 (0.37) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL23936114 0.89 L3MBTL1 (0.43) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL23936091 0.89 MEN1 (0.38) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL23936458 0.89 MEN1 (0.40) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL22986991 0.88 L3MBTL1 (0.40) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL23936171 0.87 MEN1 (0.39) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL19885771 0.87 L3MBTL1 (0.39) L3MBTL1ADORA2AADORA1ADORA3ADORA2B

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