SCHEMBL16066491

SCHEMBL16066491

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c6ccccc6c6nc7ccccc7n6c5cc43)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.44
HPGD P15428 7/20 0.44
ALDH1A1 P00352 7/20 0.44
MAPT P10636 3/20 0.40
LMNA P02545 3/20 0.40
POLB P06746 2/20 0.40
HSD17B10 Q99714 2/20 0.40
TP53 P04637 1/20 0.40
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 2/20 0.35
HIF1A Q16665 1/20 0.35
ADORA2A P29274 2/20 0.34
GLA P06280 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ACHE P22303 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
NCOA3 Q9Y6Q9 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
SCHEMBL16067136 0.99 KDM4E (0.43) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL16066693 0.97 KDM4E (0.45) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL16066954 0.96 KDM4E (0.44) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL16066543 0.95 KDM4E (0.42) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL16066779 0.92 KDM4E (0.43) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL16066111 0.91 KDM4E (0.44) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL16067111 0.91 KDM4E (0.44) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL16067135 0.89 HPGD (0.43) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL16066547 0.89 HPGD (0.44) KDM4EHPGDALDH1A1MAPTLMNA
SCHEMBL17033701 0.89 HPGD (0.39) KDM4EHPGDALDH1A1MAPTLMNA

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-2014142488-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME 주식회사 두산 (KR) 2014-09-18 WO disclosed