SCHEMBL22747643

SCHEMBL22747643

c1cnc2c(c1)c1ncccc1n2-c1nc(-n2c3cccnc3c3cccnc32)nc(-n2c3cccnc3c3cccnc32)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
L3MBTL1 Q9Y468 4/20 0.40
MPI P34949 1/20 0.40
PDE4A P27815 5/20 0.38
PDE4B Q07343 4/20 0.38
PDE4C Q08493 4/20 0.38
PDE4D Q08499 4/20 0.38
HSP90AA1 P07900 4/20 0.38
NPC1 O15118 2/20 0.38
LMNA P02545 4/20 0.38
TSHR P16473 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP2C19 P33261 1/20 0.38
CCR1 P32246 3/20 0.38
CCR8 P51685 3/20 0.38
HTT P42858 3/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GMNN O75496 1/20 0.38
TP53 P04637 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
SCHEMBL12113765 0.84 KDM4E (0.41) KDM4EL3MBTL1MPIHSP90AA1NPC1
SCHEMBL12383136 0.82 DDB1 (0.36) CYP2D6ACHE
SCHEMBL12383146 0.79 POLB (0.40) KDM4EL3MBTL1MPIPDE4APDE4B
SCHEMBL17208326 0.78 ALDH1A1 (0.34) KDM4EL3MBTL1PDE4APDE4BPDE4C
SCHEMBL16353128 0.77 CYP2C19 (0.48) L3MBTL1PDE4APDE4BPDE4CPDE4D
SCHEMBL23322798 0.76 ALDH1A1 (0.37) KDM4EL3MBTL1PDE4APDE4BPDE4C
SCHEMBL23322782 0.76 ALDH1A1 (0.44) KDM4EL3MBTL1PDE4APDE4BPDE4C
SCHEMBL23320751 0.76 CCR1 (0.42) KDM4EL3MBTL1PDE4APDE4BPDE4C
SCHEMBL23322534 0.75 ALDH1A1 (0.43) KDM4EL3MBTL1PDE4APDE4BPDE4C
SCHEMBL23322784 0.75 CCR1 (0.35) KDM4EL3MBTL1PDE4APDE4BPDE4C

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11424418-B2 Metal complex organic electroluminescent material and organic electroluminescent device SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2022-08-23 US disclosed
US-20200381633-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2020-12-03 US disclosed