SCHEMBL14968296

SCHEMBL14968296

C[C@H](N=C=O)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
CA12 O43570 1/20 0.32
CA14 Q9ULX7 1/20 0.32
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
DGAT1 O75907 1/20 0.30
ABCB1 P08183 1/20 0.30

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
SCHEMBL12484364 1.00 NOS1 (0.33) NOS1NOS3NOS2CTSSCTSK
SCHEMBL3310723 0.80 CTSS (0.34) NOS1NOS3NOS2CTSSCTSK
SCHEMBL3400364 0.80 CTSS (0.34) NOS1NOS3NOS2CTSSCTSK
SCHEMBL3400359 0.80 CTSS (0.34) NOS1NOS3NOS2CTSSCTSK
SCHEMBL12484953 0.79 NOS1 (0.31) NOS1NOS3NOS2CTSSCTSK
SCHEMBL31084746 0.78
SCHEMBL26129392 0.78
SCHEMBL15411838 0.78 CTSS (0.32) CTSSCTSKLMNAKMT2ACA1
SCHEMBL28079855 0.78 CTSS (0.32) CTSSCTSKLMNAKMT2ACA1
SCHEMBL20630584 0.76 CTSK (0.36) NOS1NOS3NOS2CTSSCTSK

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10335409-B2 Inhibitors of hepatitis C virus GILEAD PHARMASSET LLC (US) 2019-07-02 US disclosed
US-9655944-B2 Inhibitors of hepatitis C virus GILEAD SCIENCES, INC. (US) 2017-05-23 US disclosed
EP-2780031-A1 GLUCAGON SUPERFAMILY PEPTIDES EXHIBITING GLUCOCORTICOID RECEPTOR ACTIVITY Indiana University Research and Technology Corporation (US) 2014-09-24 EP disclosed
WO-2013074910-A1 GLUCAGON SUPERFAMILY PEPTIDES EXHIBITING GLUCOCORTICOID RECEPTOR ACTIVITY INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2013-05-23 WO 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 (1 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-10335409-B2 Inhibitors of hepatitis C virus HAVCR2, SLC10A1, GOT1 NOS1 3376/4885NOS3 2585/4885NOS2 3225/4885

“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.