SCHEMBL20018436

SCHEMBL20018436

C1=CCCC(C2=C3C(=C(C4=Nc5ccccc5C4)c4ccccc43)c3ccccc32)=C1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.32
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 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
SCHEMBL20018351 0.83 TDP1 (0.31)
SCHEMBL15745278 0.74 MAPT (0.40) HRH4NOS3NOS1NOS2
SCHEMBL2428720 0.72 HRH4 (0.36) HRH4NOS3NOS1NOS2
SCHEMBL13961627 0.69 HRH4 (0.46) HRH4NOS3NOS1NOS2
SCHEMBL5021700 0.67 NOS3 (0.46) HRH4NOS3NOS1NOS2
SCHEMBL15745299 0.64 KDM4E (0.33) HRH4
SCHEMBL15745290 0.64 KDM4E (0.36) HRH4NOS3NOS1NOS2
SCHEMBL19068897 0.63 NOS3 (0.45) NOS3NOS2
SCHEMBL10039077 0.62 HRH4 (0.44) HRH4NOS3NOS1NOS2
SCHEMBL13485748 0.62 MEN1 (0.56) HRH4

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
EP-2765832-B1 Multicyclic aromatic compound and organic light emitting device using the same HEESUNG MAT LTD (KR) 2018-04-04 EP disclosed