SCHEMBL20188077

SCHEMBL20188077

O=C(O)COc1cc(CCNS(=O)(=O)CCCCCN2CC(=O)NC2=O)ccc1F

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DUT P33316 16/20 0.56
TBXA2R P21731 1/20 0.33
TBXAS1 P24557 1/20 0.33

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
SCHEMBL20188063 0.87 DUT (0.51) DUT
SCHEMBL20189332 0.87 DUT (0.65) DUT
SCHEMBL20191188 0.86 DUT (0.68) DUT
SCHEMBL20188194 0.85 DUT (0.68) DUT
SCHEMBL20187732 0.85 DUT (0.51) DUT
SCHEMBL20191185 0.85 DUT (0.66) DUT
SCHEMBL20196487 0.85 DUT (0.47) DUT
SCHEMBL20188083 0.85 DUT (0.59) DUT
SCHEMBL20188184 0.85 DUT (0.64) DUT
SCHEMBL20188042 0.85 DUT (0.48) DUTTBXA2R

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-2018098206-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed