SCHEMBL23936753

SCHEMBL23936753

CC1(C)c2ccccc2-c2ccccc2C1(c1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1)c1cccc2oc3ccccc3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ATM Q13315 1/20 0.42
WHR1 P49842 1/20 0.35
NUDT1 P36639 3/20 0.32
ADORA2A P29274 2/20 0.31
CYP1A2 P05177 3/20 0.31
CYP3A4 P08684 3/20 0.31
CYP2D6 P10635 3/20 0.31
CYP2C19 P33261 3/20 0.31
CLK4 Q9HAZ1 3/20 0.31
USP2 O75604 2/20 0.31
CYP2C9 P11712 2/20 0.31
HSD17B10 Q99714 2/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 3/20 0.31
TSHR P16473 2/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL23936666 0.91 TSHR (0.32) KMT2AATMUSP2HSD17B10MAPK1
SCHEMBL23936011 0.90 TDP1 (0.36) MEN1KMT2AATMCYP1A2USP2
SCHEMBL23936609 0.86 ATM (0.51) MEN1KMT2AATMWHR1NUDT1
SCHEMBL23936613 0.83 TSHR (0.31) KMT2AATMUSP2HSD17B10MAPK1
SCHEMBL23935993 0.81 MEN1 (0.43) MEN1KMT2AATMWHR1NUDT1
SCHEMBL23936840 0.81 MEN1 (0.42) MEN1KMT2AATMWHR1NUDT1
SCHEMBL23936073 0.78 TERT (0.32) MEN1KMT2AATMUSP2HSD17B10
SCHEMBL25924136 0.77 MEN1 (0.42) MEN1KMT2AATMWHR1NUDT1
SCHEMBL23936476 0.76
SCHEMBL21975641 0.76 MEN1 (0.45) MEN1KMT2AATMWHR1NUDT1

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