SCHEMBL21709236

SCHEMBL21709236

c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3ccccc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
NPSR1 Q6W5P4 3/20 0.48
MAPK1 P28482 2/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HPGD P15428 5/20 0.47
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
ALDH1A1 P00352 4/20 0.43
NTSR1 P30989 1/20 0.43
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
TSPO P30536 1/20 0.39
KDM4E B2RXH2 2/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 1/20 0.38
GLA P06280 1/20 0.38
DHODH Q02127 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
NPY5R Q15761 1/20 0.37

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
SCHEMBL17228153 1.00 MAPT (0.48) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL6374211 0.99 MAPT (0.49) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL21965147 0.96 MAPT (0.49) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL21965146 0.96 MAPT (0.49) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL17228142 0.95 KDM4E (0.45) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL15197795 0.95 KDM4E (0.45) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL6375115 0.95 KDM4E (0.45) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL16234030 0.95 KDM4E (0.45) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL15459672 0.95 MAPT (0.44) MAPTNPSR1MAPK1TSHRHSD17B10
SCHEMBL6372983 0.95 MAPT (0.44) MAPTNPSR1MAPK1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022010302-A1 ORGANIC ELECTRONIC ELEMENT CONTAINING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2022-01-13 WO disclosed
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