SCHEMBL17520404

SCHEMBL17520404

CCOCCCC(C)(C)NS(C)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DUT P33316 15/20 0.36
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NSD2 O96028 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL17520385 0.87 DUT (0.35) DUTALDH1A1TSHR
SCHEMBL4790668 0.78 CA1 (0.34) ALDH1A1
SCHEMBL17520383 0.75 EPHX1 (0.37)
SCHEMBL20376222 0.74 ALDH1A1 (0.33) ALDH1A1KDM4ETDP1
SCHEMBL13164464 0.73 ALDH1A1 (0.39) ALDH1A1
SCHEMBL21189211 0.71
SCHEMBL19558179 0.71 DUT (0.34) DUT
SCHEMBL24522266 0.69 TRPA1 (0.32)
SCHEMBL9888776 0.68 GAA (0.51) GAAL3MBTL1ALDH1A1TSHRKDM4E
SCHEMBL1754136 0.68 PARG (0.37) TSHRTDP1

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 5 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
US-9809571-B2 Deoxyuridine triphosphatase inhibitors UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2017-11-07 US disclosed
US-9790214-B2 Heteroatom containing deoxyuridine triphosphatase inhibitors UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2017-10-17 US disclosed
US-20160326149-A1 HETEROATOM CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS UNIVERSITY OF SOUTHERN CALIFORNIA 2016-11-10 US disclosed
US-20160039788-A1 DEOXYURIDINE TRIPHOSPHATASE INHIBITORS UNIVERSITY OF SOUTHERN CALIFORNIA 2016-02-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160326149-A1 HETEROATOM CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS TYMP, DUT, TYMS DUT 2/4885GAA 527/4885L3MBTL1 1184/4885
US-20160039788-A1 DEOXYURIDINE TRIPHOSPHATASE INHIBITORS DUT, TYMP, DPYD DUT 1/4885GAA 346/4885L3MBTL1 1873/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.