SCHEMBL20201702

SCHEMBL20201702

CCC(O)(CNCCCCCCN1CCC(=O)NC1=O)c1ccc(F)c(OCC(C)C)c1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DUT P33316 17/20 0.65
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL20207749 1.00 DUT (0.65) DUTMEN1ALDH1A1GAATSHR
SCHEMBL18374676 0.87 DUT (0.86) DUT
SCHEMBL20204680 0.81 DUT (0.45) DUTMEN1ALDH1A1GAATSHR
SCHEMBL18374333 0.81 DUT (0.86) DUT
SCHEMBL20201493 0.80 DUT (0.76) DUT
SCHEMBL21690953 0.79 DUT (0.71) DUT
SCHEMBL21690954 0.79 DUT (0.71) DUT
SCHEMBL18374305 0.79 DUT (1.00) DUT
SCHEMBL20560923 0.79 DUT (0.86) DUT
SCHEMBL18374665 0.79 DUT (0.86) 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