SCHEMBL23936216

SCHEMBL23936216

CC1(C)c2ccccc2-c2c(-c3cc4ccccc4cc3-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cccc2C1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.39
MAPK1 P28482 5/20 0.39
TSHR P16473 4/20 0.39
ALDH1A1 P00352 4/20 0.39
TP53 P04637 3/20 0.39
HSD17B10 Q99714 2/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HIF1A Q16665 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
ADORA2A P29274 3/20 0.36
ADORA1 P30542 3/20 0.36
ALOX15 P16050 2/20 0.36
ADORA3 P0DMS8 2/20 0.36
ADORA2B P29275 2/20 0.36
MAPT P10636 4/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
LMNA P02545 3/20 0.33
TDP1 Q9NUW8 3/20 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
SCHEMBL23936182 0.90 L3MBTL1 (0.41) HPGDMAPK1TSHRALDH1A1TP53
SCHEMBL23936114 0.90 L3MBTL1 (0.43) HPGDMAPK1TSHRALDH1A1TP53
SCHEMBL23936285 0.88 MEN1 (0.40) HPGDTSHRALDH1A1TP53HSD17B10
SCHEMBL23936424 0.87 L3MBTL1 (0.39) HPGDMAPK1TSHRALDH1A1TP53
SCHEMBL23936709 0.87 L3MBTL1 (0.39) HPGDMAPK1TSHRALDH1A1TP53
SCHEMBL23936127 0.87 L3MBTL1 (0.41) HPGDMAPK1TSHRALDH1A1TP53
SCHEMBL18386136 0.86 ALDH1A1 (0.37) HPGDMAPK1TSHRALDH1A1TP53
SCHEMBL23936125 0.86 L3MBTL1 (0.38) HPGDMAPK1TSHRALDH1A1TP53
SCHEMBL23936684 0.86 ADORA2A (0.39) HPGDMAPK1TSHRALDH1A1L3MBTL1
SCHEMBL23936411 0.86 L3MBTL1 (0.38) HPGDTSHRALDH1A1HSD17B10L3MBTL1

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