SCHEMBL16613419

SCHEMBL16613419

c1ccc(-c2ccccc2-c2nc(-n3c4ccccc4c4ccc5c(ccn5-c5ccccc5)c43)nc3sccc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.33
PTGER1 P34995 1/20 0.31

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
SCHEMBL16613453 0.92 VCP (0.35) VCP
SCHEMBL16613529 0.92 VCP (0.33) VCP
SCHEMBL16613457 0.91 VCP (0.32) VCP
SCHEMBL16613487 0.91 VCP (0.33) VCP
SCHEMBL16613468 0.91 VCP (0.34) VCP
SCHEMBL16613420 0.89 VCP (0.31) VCP
SCHEMBL16613544 0.89 VCP (0.33) VCP
SCHEMBL16613545 0.89 ADORA2A (0.36) VCP
SCHEMBL16613454 0.88 VCP (0.33) VCP
SCHEMBL16613421 0.88 VCP (0.30) VCP

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed