SCHEMBL17033476

SCHEMBL17033476

c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccccc5c5ccc6c(nc7c8ccccc8c8ccccc8n67)c54)c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
HPGD P15428 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
ALOX12 P18054 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MCL1 Q07820 1/20 0.31
DHODH Q02127 1/20 0.30

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
SCHEMBL17033696 0.94 KDM4E (0.32) KDM4ETSHRHSD17B10ALDH1A1HPGD
SCHEMBL17033493 0.91 MAPT (0.38) KDM4ETSHRHSD17B10ALDH1A1MEN1
SCHEMBL17033688 0.88 MAPT (0.39) KDM4ETSHRHSD17B10ALDH1A1MEN1
SCHEMBL17033537 0.87 KDM4E (0.33) KDM4EALDH1A1MEN1KMT2APOLB
SCHEMBL17033539 0.87 MAPT (0.32) KDM4ETSHRHSD17B10ALDH1A1MEN1
SCHEMBL17033717 0.86 PDE4A (0.36) KDM4ETSHRHSD17B10ALDH1A1HPGD
SCHEMBL17033699 0.85 MEN1 (0.33) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL17033777 0.84 HSD17B10 (0.35) KDM4ETSHRHSD17B10ALDH1A1MEN1
SCHEMBL17033705 0.84 KDM4E (0.33) KDM4ETSHRHSD17B10ALDH1A1MEN1
SCHEMBL16066125 0.84 HPGD (0.44) KDM4EHSD17B10ALDH1A1MEN1KMT2A

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