SCHEMBL13639136

SCHEMBL13639136

CCCCC(O)C1(CC)CCC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.33
MAPK1 P28482 1/20 0.33
CA1 P00915 3/20 0.32
PTGER2 P43116 2/20 0.32
ALDH1A1 P00352 1/20 0.31
FDPS P14324 1/20 0.30
PTGIR P43119 1/20 0.30
DNM1 Q05193 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
SCHEMBL12298894 1.00 CA2 (0.33) CA2MAPK1CA1PTGER2ALDH1A1
SCHEMBL11981966 0.87
SCHEMBL13639140 0.87
SCHEMBL15178057 0.86 PTGER2 (0.36) CA2MAPK1CA1PTGER2ALDH1A1
SCHEMBL13849974 0.86 PTGER2 (0.36) CA2MAPK1CA1PTGER2ALDH1A1
SCHEMBL11981982 0.83
SCHEMBL11981889 0.81
SCHEMBL2444823 0.81 UGT2B7 (0.31)
SCHEMBL13639137 0.78 TSHR (0.31)
SCHEMBL11981878 0.78 LMNA (0.30)

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-1481976-B1 8-AZAPROSTAGLANDIN DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2012-11-07 EP disclosed