SCHEMBL17033871

SCHEMBL17033871

c1ccc(-c2cccc(-c3ncnc(-n4c5ccccc5c5ccc6c(nc7c8ccccc8c8ccccc8n67)c54)n3)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.32
POLB P06746 1/20 0.30
PIK3CA P42336 1/20 0.30
MTOR P42345 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
SCHEMBL17033894 0.99 LIMK1 (0.33) LIMK1POLB
SCHEMBL17033692 0.90 POLB (0.32) POLB
SCHEMBL17033896 0.85
SCHEMBL17033888 0.85 LIMK1 (0.32) LIMK1PIK3CAMTOR
SCHEMBL17033892 0.85 PIK3CA (0.35) POLBPIK3CA
SCHEMBL17033721 0.85 POLB (0.32) POLB
SCHEMBL17033911 0.85 LIMK1 (0.33) LIMK1
SCHEMBL17033872 0.84 PIK3CA (0.34) PIK3CA
SCHEMBL17033881 0.83 KMO (0.35) LIMK1POLB
SCHEMBL17033723 0.83 NR3C1 (0.32) POLB

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