SCHEMBL16185686

SCHEMBL16185686

c1cc(-c2cc(-c3ccc4oc5ccccc5c4c3)nc(-c3ccc4oc5ccccc5c4c3)n2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 1/20 0.39
KDM4E B2RXH2 5/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
MAPT P10636 5/20 0.37
ALDH1A1 P00352 5/20 0.37
HPGD P15428 5/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 1/20 0.36
GLA P06280 1/20 0.35
CASP3 P42574 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
PLA2G2A P14555 2/20 0.34
PLA2G4A P47712 2/20 0.34
PLA2G10 O15496 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
SCHEMBL16185444 1.00 CHEK2 (0.39) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL16811387 0.98 KDM4E (0.39) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL16185440 0.98 KMT2A (0.41) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL16185704 0.98 KMT2A (0.41) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL18565644 0.96 CHEK2 (0.37) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL16185511 0.95 PLA2G2A (0.39) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL16185666 0.95 MEN1 (0.39) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL16185739 0.95 MEN1 (0.39) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL16185403 0.94 MEN1 (0.39) CHEK2KDM4EATML3MBTL1MEN1
SCHEMBL15395099 0.94 KMT2A (0.39) CHEK2KDM4EATML3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9847501-B2 Aromatic heterocyclic derivative, material for organic electroluminescent element, and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2017-12-19 US disclosed
US-9847501-B2 Aromatic heterocyclic derivative, material for organic electroluminescent element, and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2017-12-19 US disclosed
US-20140312338-A1 AROMATIC HETEROCYCLIC DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-10-23 US disclosed
US-20140312338-A1 AROMATIC HETEROCYCLIC DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-10-23 US disclosed