SCHEMBL5268876

SCHEMBL5268876

[CH2]CCc1c(SCCCCCCC)cccc1SCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.46
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41
EPHX2 P34913 1/20 0.39
SOAT1 P35610 9/20 0.37
KCNH2 Q12809 2/20 0.37
GPR84 Q9NQS5 1/20 0.35

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
SCHEMBL5268650 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5273041 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5266701 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5266381 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5273010 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5271596 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5269961 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5340921 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5271457 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1
SCHEMBL5269100 1.00 PTGS2 (0.46) PTGS2CYSLTR2CYSLTR1EPHX2SOAT1

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-1843407-A1 Liquid crystalline rylenetetracarboxylic acid derivatives and their use BASF AKTIENGESELLSCHAFT (DE) 2007-10-10 EP disclosed