SCHEMBL17033666

SCHEMBL17033666

c1ccc(-c2ccc(-c3cc(-n4c5ccccc5c5cc6nc7c8ccccc8c8ccccc8n7c6cc54)nc(-c4ccc(-c5ccccc5)cc4)n3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HPGD P15428 6/20 0.38
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 4/20 0.38
KMT2A Q03164 4/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 3/20 0.34
NTSR1 P30989 1/20 0.34
DHODH Q02127 1/20 0.33
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
POLB P06746 2/20 0.32
ACACA Q13085 1/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 1/20 0.32
MAOA P21397 1/20 0.31

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
SCHEMBL17033813 0.98 MAPT (0.40) MAPTHSD17B10TSHRMAPK1NPSR1
SCHEMBL16067135 0.91 HPGD (0.43) MAPTHSD17B10TSHRMAPK1NPSR1
SCHEMBL17033701 0.90 HPGD (0.39) MAPTHSD17B10TSHRMAPK1HPGD
SCHEMBL16066955 0.89 HPGD (0.43) MAPTHSD17B10TSHRMAPK1NPSR1
SCHEMBL16066547 0.88 HPGD (0.44) MAPTHSD17B10TSHRMAPK1NPSR1
SCHEMBL16066680 0.87 HPGD (0.45) MAPTHSD17B10TSHRMAPK1NPSR1
SCHEMBL17033707 0.87 HPGD (0.41) MAPTHSD17B10TSHRHPGDALDH1A1
SCHEMBL17033681 0.86 NR1I3 (0.36) MAPTHPGDALDH1A1KDM4EKMT2A
SCHEMBL17033843 0.86 KDM4E (0.40) MAPTHSD17B10HPGDALDH1A1KDM4E
SCHEMBL17033710 0.86 KDM4E (0.40) MAPTHSD17B10MAPK1NPSR1HPGD

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
WO-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed