SCHEMBL16613814

SCHEMBL16613814

c1ccc(-c2ccc(-n3c4ccc(-c5c(-c6ccccc6)cccc5-c5ccccc5)cc4c4ccc5c(ccn5-c5ccccc5)c43)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SETD7 Q8WTS6 1/20 0.32
▸ EHMT2 Q96KQ7 1/20 0.32
▸ MAOB P27338 1/20 0.30
▸ MAPK14 Q16539 1/20 0.30
▸ HTR7 P34969 1/20 0.30
▸ ESR1 P03372 1/20 0.30
▸ ESRRA P11474 1/20 0.30
▸ ESR2 Q92731 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
SCHEMBL16613829 1.00 SETD7 (0.32) SETD7EHMT2MAOBMAPK14HTR7
SCHEMBL16613858 0.98 SETD7 (0.33) SETD7EHMT2MAPK14
SCHEMBL16613654 0.93 SETD7 (0.31) SETD7EHMT2
SCHEMBL16613817 0.93 SETD7 (0.33) SETD7EHMT2
SCHEMBL16613828 0.93 MAOB (0.32) SETD7EHMT2MAOBHTR7ESR1
SCHEMBL16613824 0.93 MAOB (0.32) SETD7EHMT2MAOBHTR7ESR1
SCHEMBL16613827 0.90 MAOB (0.35) MAOBHTR7
SCHEMBL16613786 0.90 KDM4E (0.33) SETD7EHMT2MAOBMAPK14
SCHEMBL16613708 0.90 MAOB (0.35) MAOBHTR7
SCHEMBL16613826 0.90 MAOB (0.36) MAOBHTR7

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-2015046981-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2015-04-02 — — WO disclosed
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