SCHEMBL23936692

SCHEMBL23936692

CC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccccc5)cc4)n3)cc2C1(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 9/20 0.44
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
ALDH1A1 P00352 4/20 0.44
MAPT P10636 4/20 0.44
HPGD P15428 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
NTSR1 P30989 1/20 0.40
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
GLA P06280 1/20 0.39
ADORA2A P29274 2/20 0.38
ADORA1 P30542 2/20 0.38
ADORA3 P0DMS8 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
ADORA2B P29275 1/20 0.36
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL23936256 0.98 MEN1 (0.45) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL26438236 0.96 PDK2 (0.44) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL26438228 0.94 PDK2 (0.43) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL26438216 0.94 PDK2 (0.43) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936691 0.94 PDK2 (0.42) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936130 0.94 PDK2 (0.42) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936164 0.94 MEN1 (0.46) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23935971 0.94 MEN1 (0.46) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23935997 0.93 MEN1 (0.41) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936209 0.92 MEN1 (0.42) 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