SCHEMBL20187944

SCHEMBL20187944

CC(C)COc1cc(CCNS(=O)(=O)CCCCCN2C(=O)NC(=O)[C@H]2C)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DUT P33316 15/20 0.46
SMN1; SMN2 Q16637 1/20 0.33
HRH1 P35367 1/20 0.33
KCNH2 Q12809 1/20 0.33
SCN9A Q15858 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL20188094 0.86 DUT (0.40) DUTSMN1; SMN2MAPT
SCHEMBL22723240 0.83 DUT (0.55) DUT
SCHEMBL22723244 0.83 DUT (0.55) DUT
SCHEMBL22723242 0.83 DUT (0.55) DUT
SCHEMBL20187875 0.82 DUT (0.44) DUTSCN9A
SCHEMBL18374309 0.82 DUT (0.44) DUTSCN9A
SCHEMBL18374307 0.82 DUT (0.44) DUTSCN9A
SCHEMBL20190545 0.78 DUT (0.43) DUTSMN1; SMN2KCNH2
SCHEMBL20189332 0.75 DUT (0.65) DUT
SCHEMBL20187800 0.74 DUT (0.54) DUT

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