SCHEMBL23936760

SCHEMBL23936760

CC1(C)c2ccccc2-c2ccc(-c3cccc4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 7/20 0.39
LMNA P02545 5/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 7/20 0.39
ALDH1A1 P00352 5/20 0.39
GAA P10253 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
PIM1 P11309 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
AKT1 P31749 1/20 0.37
AKT2 P31751 1/20 0.37
PDE10A Q9Y233 1/20 0.36
ATM Q13315 1/20 0.36
TLR9 Q9NR96 1/20 0.36
HTT P42858 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL23936460 0.92 TDP1 (0.41) TDP1KMT2AMEN1KDM4ELMNA
SCHEMBL23936113 0.88 TDP1 (0.50) TDP1KMT2AMEN1KDM4ELMNA
SCHEMBL23936706 0.87 TDP1 (0.49) TDP1KMT2AMEN1KDM4ELMNA
SCHEMBL23936469 0.85 KMT2A (0.43) TDP1KMT2AMEN1KDM4ELMNA
SCHEMBL22186250 0.84 KDM4E (0.42) TDP1KMT2AMEN1KDM4ELMNA
SCHEMBL23936473 0.84 ALDH1A1 (0.50) TDP1KMT2AMEN1KDM4ELMNA
SCHEMBL23935995 0.83 KDM4E (0.39) TDP1KMT2AKDM4ELMNASMN1; SMN2
SCHEMBL12207288 0.83 TDP1 (0.35) TDP1KMT2AMEN1KDM4ELMNA
SCHEMBL23936435 0.82 KMT2A (0.42) TDP1KMT2AMEN1KDM4ELMNA
SCHEMBL12207668 0.81 ALDH1A1 (0.33) TDP1KMT2AMEN1KDM4ELMNA

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