SCHEMBL29316828

SCHEMBL29316828

Nn1c2ncccc2c2cccnc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.44
MAPT P10636 3/20 0.44
HSP90AA1 P07900 5/20 0.41
HSP90AB1 P08238 2/20 0.41
IDO1 P14902 2/20 0.41
PSMB5 P28074 1/20 0.41
L3MBTL1 Q9Y468 5/20 0.39
NPC1 O15118 3/20 0.39
LDHA P00338 1/20 0.39
FEN1 P39748 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39
DDB1 Q16531 1/20 0.38

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
SCHEMBL257570 0.85 ACHE (0.39) KDM4EMAPTHSP90AA1HSP90AB1IDO1
SCHEMBL25944782 0.79 DDB1 (0.46) KDM4EHTTDDB1CRBNKDM6B
SCHEMBL24421411 0.76 CYP1A2 (0.39) KDM4EMAPTHSP90AA1IDO1L3MBTL1
SCHEMBL24822444 0.75 KDM4E (0.44) KDM4EMAPTHSP90AA1HSP90AB1IDO1
SCHEMBL1609990 0.75 FEN1 (0.56) KDM4EMAPTHSP90AA1L3MBTL1NPC1
SCHEMBL3213880 0.72 SLC6A2 (0.43) KDM4EMAPTHSP90AA1L3MBTL1NPC1
SCHEMBL29224069 0.72 ELANE (0.50) KDM4EMAPTHSP90AA1HSP90AB1IDO1
SCHEMBL23892921 0.71 KDM4E (0.36) KDM4EMAPTHSP90AA1HSP90AB1IDO1
SCHEMBL18633919 0.70 ELANE (0.43) KDM4EMAPTHSP90AA1HSP90AB1IDO1
SCHEMBL12759645 0.70 PDE3B (0.49) KDM4EMAPTHSP90AA1L3MBTL1NPC1

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
EP-4400559-A1 LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE ORGANOMETALLIC COMPOUND Samsung Display Co., Ltd. (KR) 2024-07-17 EP disclosed