SCHEMBL21709013

SCHEMBL21709013

c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-n4c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c5cc6ccccc6cc54)cc3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ATM Q13315 1/20 0.50
TSPO P30536 2/20 0.39
HDAC4 P56524 1/20 0.39
PTGER4 P35408 1/20 0.37
NPY5R Q15761 2/20 0.37
KMT2A Q03164 2/20 0.37
IL1R1 P14778 1/20 0.37
HTR6 P50406 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
NR3C1 P04150 1/20 0.35
PTPN1 P18031 1/20 0.34
TSHR P16473 1/20 0.34
DNM1 Q05193 1/20 0.34
AKR1C4 P17516 1/20 0.34
AKR1C3 P42330 1/20 0.34

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
SCHEMBL19271629 0.96 L3MBTL1 (0.49) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL17990482 0.94 L3MBTL1 (0.53) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL17689857 0.94 L3MBTL1 (0.53) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL12414463 0.94 L3MBTL1 (0.52) L3MBTL1KDM4EATMHDAC4NPY5R
SCHEMBL17943726 0.94 L3MBTL1 (0.52) L3MBTL1KDM4EATMHDAC4NPY5R
SCHEMBL17990484 0.93 L3MBTL1 (0.51) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL18789960 0.93 L3MBTL1 (0.58) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL24765785 0.92 L3MBTL1 (0.53) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL17990462 0.91 L3MBTL1 (0.56) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL18962985 0.91 L3MBTL1 (0.60) L3MBTL1KDM4EATMTSPOHDAC4

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
WO-2020032424-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING, AS HOST MATERIAL, MIXTURE OF DIFFERENT KINDS OF COMPOUNDS, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2020-02-13 WO disclosed
WO-2020032447-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING, AS HOST MATERIAL, MIXTURE OF DIFFERENT KINDS OF COMPOUNDS, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2020-02-13 WO disclosed