SCHEMBL17033839

SCHEMBL17033839

Fc1cccc(-c2cc(-c3cccc(F)c3)nc(-n3c4ccccc4c4c3ccc3cc5c6ccccc6c6ccccc6n5c34)c2)c1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 1/20 0.33
PTGER1 P34995 1/20 0.32
IDO1 P14902 1/20 0.32
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.32
XBP1 P17861 1/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ACHE P22303 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
SCHEMBL17033573 0.91 KDM4E (0.32) KDM4E
SCHEMBL17033823 0.89 PTGER1 (0.34) KDM5BPTGER1IDO1KDM4EALDH1A1
SCHEMBL17033669 0.88 KDM4E (0.34) KDM5BPTGER1IDO1KDM4EALDH1A1
SCHEMBL17033560 0.88 KDM4E (0.34) KDM4EALDH1A1MAPT
SCHEMBL17033832 0.87 KDM4E (0.33) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL17033510 0.84 KDM4E (0.35) KDM5BPTGER1IDO1KDM4EALDH1A1
SCHEMBL17033762 0.83 PTGER1 (0.34) KDM5BPTGER1IDO1KDM4EALDH1A1
SCHEMBL17033405 0.83 KDM4E (0.34) KDM5BPTGER1IDO1KDM4EALDH1A1
SCHEMBL16066604 0.82 ALDH1A1 (0.38) PTGER1KDM4EALDH1A1HTTXBP1
SCHEMBL16066842 0.81

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