SCHEMBL23936632

SCHEMBL23936632

CC1(C)c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2-c2cc3ccc4ccccc4c3cc2C1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.40
MAPT P10636 7/20 0.40
HPGD P15428 7/20 0.40
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
LMNA P02545 3/20 0.38
HSD17B10 Q99714 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP1B1 Q16678 2/20 0.38
NPC1 O15118 1/20 0.38
RECQL P46063 1/20 0.38
RAB9A P51151 1/20 0.38
HIF1A Q16665 1/20 0.38
KDM4E B2RXH2 4/20 0.36
ATM Q13315 2/20 0.36
GLA P06280 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
CYP11B1 P15538 1/20 0.35
CYP1A2 P05177 2/20 0.34
NTSR1 P30989 1/20 0.34

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
SCHEMBL23936526 0.96 MAPT (0.38) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL23936524 0.96 ALDH1A1 (0.39) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL23936318 0.95 ALDH1A1 (0.40) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL23936350 0.91 KMT2A (0.38) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL23936379 0.91 ALDH1A1 (0.39) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL23936237 0.89 MAPT (0.37) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL23936639 0.88 MEN1 (0.38) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL26438226 0.88 MAPT (0.36) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL23936633 0.87 ALDH1A1 (0.33) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL26438213 0.85 PDK2 (0.38) ALDH1A1MAPTHPGDMEN1KMT2A

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