SCHEMBL23936609

SCHEMBL23936609

CC1(C)c2ccccc2-c2ccccc2C1(c1ccccc1)c1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
WHR1 P49842 1/20 0.40
NUDT1 P36639 3/20 0.38
ADORA2A P29274 2/20 0.38
NPC1 O15118 1/20 0.37
XBP1 P17861 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
ACP1 P24666 3/20 0.36
PDE5A O76074 3/20 0.36
CYP1A2 P05177 2/20 0.36
MAPT P10636 2/20 0.36
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
LMNA P02545 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
SCHEMBL23935993 0.91 MEN1 (0.43) ATMMEN1KMT2AWHR1NUDT1
SCHEMBL23936074 0.86 L3MBTL1 (0.41) ATMMEN1KMT2AADORA2ANPC1
SCHEMBL23936840 0.86 MEN1 (0.42) ATMMEN1KMT2AWHR1NUDT1
SCHEMBL23936753 0.86 MEN1 (0.42) ATMMEN1KMT2AWHR1NUDT1
SCHEMBL23936608 0.85 TDP1 (0.47) ATMMEN1KMT2ANPC1RAB9A
SCHEMBL23936717 0.83 MEN1 (0.53) ATMMEN1KMT2AWHR1NUDT1
SCHEMBL23936277 0.83 MEN1 (0.50) ATMMEN1KMT2AWHR1NUDT1
SCHEMBL19293843 0.83 MEN1 (0.56) ATMMEN1KMT2AWHR1NUDT1
SCHEMBL19293818 0.83 MEN1 (0.56) ATMMEN1KMT2AWHR1NUDT1
SCHEMBL23936112 0.81 MEN1 (0.51) ATMMEN1KMT2AWHR1NUDT1

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