SCHEMBL5216476

SCHEMBL5216476

CCCCCC(=O)/C=C/[C@H]1CCC(=O)N1CCSC(C)CCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 19/20 0.57
PTGER3 P43115 11/20 0.57
PTGER2 P43116 11/20 0.57
KCNH2 Q12809 1/20 0.44

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
SCHEMBL5214117 0.86 PTGER4 (0.76) PTGER4PTGER3PTGER2
SCHEMBL5214567 0.86 PTGER4 (0.76) PTGER4PTGER3PTGER2
SCHEMBL5214573 0.86 PTGER4 (0.76) PTGER4PTGER3PTGER2
SCHEMBL7245447 0.84 PTGER4 (0.72) PTGER4PTGER3PTGER2
SCHEMBL7245443 0.84 PTGER4 (0.72) PTGER4PTGER3PTGER2
SCHEMBL5216486 0.83 PTGER4 (0.59) PTGER4PTGER3PTGER2
SCHEMBL11835583 0.82 PTGER4 (0.71) PTGER4PTGER3PTGER2KCNH2
SCHEMBL14030713 0.79 PTGER4 (0.66) PTGER4PTGER3PTGER2
SCHEMBL4377089 0.79 PTGER4 (0.62) PTGER4PTGER3PTGER2KCNH2
SCHEMBL4377952 0.79 PTGER4 (0.62) PTGER4PTGER3PTGER2KCNH2

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-1408961-B1 2 PYRROLIDONE DERIVATIVES AS PROSTANOID AGONISTS HOFFMANN LA ROCHE (CH) 2007-07-11 EP disclosed