SCHEMBL23936639

SCHEMBL23936639

CC1(C)c2ccccc2-c2cc3ccc4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4c3cc2C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.38
KMT2A Q03164 7/20 0.38
MAPT P10636 5/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 5/20 0.34
KDM4E B2RXH2 3/20 0.34
ATM Q13315 2/20 0.34
GLA P06280 1/20 0.34
WHR1 P49842 1/20 0.32
TSHR P16473 3/20 0.32
ALOX15 P16050 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA2B P29275 1/20 0.32
ADORA1 P30542 1/20 0.32
NTSR1 P30989 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.31
MAPK1 P28482 2/20 0.31

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
SCHEMBL23936225 0.96 MAPT (0.35) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936636 0.96 MEN1 (0.37) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936188 0.88 MEN1 (0.37) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936632 0.88 ALDH1A1 (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL26438226 0.86 MAPT (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL26438231 0.86 MAPT (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936526 0.85 MAPT (0.38) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936624 0.85 MEN1 (0.35) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936524 0.85 ALDH1A1 (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936610 0.85 PDK2 (0.37) MEN1KMT2AMAPTALDH1A1HPGD

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