SCHEMBL23936338

SCHEMBL23936338

CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3cccc4c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc34)cc2C1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.40
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 3/20 0.39
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
GLA P06280 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
NTSR1 P30989 1/20 0.36
TSHR P16473 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
ALOX15 P16050 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
ENPP3 O14638 1/20 0.35
ATM Q13315 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL23936116 0.97 MEN1 (0.41) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936272 0.95 MEN1 (0.39) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936129 0.94 MEN1 (0.38) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936126 0.93 MEN1 (0.40) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23935977 0.92 MEN1 (0.38) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936079 0.90 PDK2 (0.40) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23935974 0.90 PDK2 (0.42) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936149 0.89 MEN1 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23936080 0.89 PDK2 (0.41) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936332 0.89 PDK2 (0.43) PDK2MEN1KMT2AALDH1A1MAPT

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