SCHEMBL28558206

SCHEMBL28558206

CCC(c1ccc(OCCO)c(C2CCCCC2)c1)c1ccc(OCCO)c(C2CCCCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 16/20 0.48
SLC6A9 P48067 1/20 0.46
PTGDR Q13258 7/20 0.44
PTGER2 P43116 1/20 0.44
HTR1D P28221 2/20 0.39
HTR1B P28222 2/20 0.39

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
SCHEMBL22229831 0.78 PTGDR2 (0.51) PTGDR2SLC6A9PTGDRPTGER2HTR1D
SCHEMBL4061776 0.76 NUDT1 (0.50) PTGDR2
SCHEMBL347064 0.76 PTGDR2 (0.52) PTGDR2SLC6A9PTGDRPTGER2HTR1D
SCHEMBL29480885 0.76 PTGDR2 (0.52) PTGDR2SLC6A9PTGDRPTGER2HTR1D
SCHEMBL11342734 0.75 KDM4E (0.40)
SCHEMBL11008773 0.75 OPRM1 (0.38)
SCHEMBL28408347 0.74 SMN1; SMN2 (0.42)
SCHEMBL11373736 0.73 PTGDR2 (0.63) PTGDR2SLC6A9PTGDRHTR1DHTR1B
SCHEMBL516573 0.73 PTGDR2 (0.63) PTGDR2SLC6A9PTGDRHTR1DHTR1B
SCHEMBL346956 0.73 PTGDR2 (0.46) PTGDR2SLC6A9PTGDRPTGER2

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
CN-107852786-B Circularly polarizing plate for organic EL display device and organic EL display device 日东电工株式会社 2021-05-11 CN disclosed