SCHEMBL20201577

SCHEMBL20201577

C[C@@H](NCCCC/C=C/CN1CCC(=O)NC1=O)c1ccc(F)c(OCC2CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DUT P33316 20/20 0.50

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
SCHEMBL20560462 0.85 DUT (0.69) DUT
SCHEMBL18374673 0.85 DUT (0.69) DUT
SCHEMBL20207646 0.85 DUT (0.60) DUT
SCHEMBL20201757 0.85 DUT (0.60) DUT
SCHEMBL20201601 0.83 DUT (0.51) DUT
SCHEMBL20207648 0.83 DUT (0.47) DUT
SCHEMBL20201858 0.83 DUT (0.47) DUT
SCHEMBL18374661 0.82 DUT (0.65) DUT
SCHEMBL18374352 0.82 DUT (0.65) DUT
SCHEMBL20376487 0.81 DUT (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018128720-A1 URACIL CONTAINING COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-07-12 WO disclosed
WO-2018098206-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed