SCHEMBL16613810

SCHEMBL16613810

CC1(C)C=Cc2c(-c3cccc4c3sc3ccccc34)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)nc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
PTGER4 P35408 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
SCHEMBL16613406 0.90 PARP14 (0.33) ALOX5
SCHEMBL16613674 0.87 PTGER4 (0.34) PTGER4
SCHEMBL16613676 0.87 PTGER4 (0.34) PTGER4
SCHEMBL16613616 0.86 PTGER4 (0.34) PTGER4
SCHEMBL16613747 0.85 PTGER4 (0.33) PTGER4
SCHEMBL16613745 0.84 KDM4E (0.37) PTGER4
SCHEMBL16613759 0.84 PTGER4 (0.33) PTGER4
SCHEMBL16613675 0.83 PTGER4 (0.35) PTGER4
SCHEMBL16613617 0.83 PTGER4 (0.33) PTGER4
SCHEMBL16613809 0.83 KDM4E (0.36) PTGER4

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