SCHEMBL17033872

SCHEMBL17033872

c1ccc(-c2ccc(-c3cccc(-c4ccnc(-n5c6ccccc6c6ccc7c(nc8c9ccccc9c9ccccc9n78)c65)n4)c3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.34
DKK1 O94907 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
SCHEMBL17033892 0.99 PIK3CA (0.35) PIK3CA
SCHEMBL17033721 0.89 POLB (0.32)
SCHEMBL17033915 0.87
SCHEMBL17033908 0.86 PIK3CA (0.34) PIK3CADKK1
SCHEMBL17033894 0.85 LIMK1 (0.33)
SCHEMBL17033876 0.85 PIK3CA (0.35) PIK3CADKK1
SCHEMBL17033539 0.85 MAPT (0.32)
SCHEMBL17033871 0.84 LIMK1 (0.32) PIK3CA
SCHEMBL17033692 0.84 POLB (0.32)
SCHEMBL17033874 0.83 KMO (0.34)

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