SCHEMBL3060283

SCHEMBL3060283

CCOC1OC(=O)CC1N

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
TK1 P04183 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
SCHEMBL7150924 1.00 SMN1; SMN2 (0.37) SMN1; SMN2TK1
SCHEMBL5502298 1.00 SMN1; SMN2 (0.37) SMN1; SMN2TK1
SCHEMBL3036948 1.00 SMN1; SMN2 (0.37) SMN1; SMN2TK1
Hydrochloric Acid SCHEMBL7928006 0.98 SMN1; SMN2 (0.35) SMN1; SMN2TK1
SCHEMBL8286842 0.85 SMN1; SMN2 (0.34) SMN1; SMN2
SCHEMBL8288852 0.85 SMN1; SMN2 (0.34) SMN1; SMN2
SCHEMBL3470163 0.84 CYP1A2 (0.33) SMN1; SMN2
SCHEMBL13201969 0.84 CYP1A2 (0.33) SMN1; SMN2
SCHEMBL8288905 0.84 CYP1A2 (0.33) SMN1; SMN2
SCHEMBL3470048 0.80 CTSV (0.37) SMN1; SMN2

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7138395-B2 Interleukin-1β converting enzyme inhibitors THE PROCTER & GAMBLE COMPANY (US) 2006-11-21 US claimed
US-7041696-B2 Interleukin-1β converting enzyme inhibitors THE PROCTER & GAMBLE COMPANY (US) 2006-05-09 US claimed
US-20040014753-A1 Novel interleukin-1beta converting enzyme inhibitors THE PROCTER & GAMBLE COMPANY 2004-01-22 US claimed
US-20030236296-A1 Novel interleukin-1beta converting enzyme inhibitors THE PROCTER & GAMBLE COMPANY 2003-12-25 US claimed
US-20200048306-A1 PRODRUG OF AN ICE INHIBITOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-02-13 US disclosed
US-20180327449-A1 PRODRUG OF AN ICE INHIBITOR VERTEX PHARMACEUTICALS INCORPORATED 2018-11-15 US disclosed
US-9994613-B2 Prodrug of an ICE inhibitor VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-06-12 US disclosed
US-20170022249-A1 PRODRUG OF AN ICE INHIBITOR VERTEX PHARMACEUTICALS INCORPORATED 2017-01-26 US disclosed
US-9487555-B2 Prodrug of an ice inhibitor VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-11-08 US disclosed
US-9156880-B2 Prodrug of an ice inhibitor VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-10-13 US disclosed
US-20150284426-A1 PRODRUG OF AN ICE INHIBITOR VERTEX PHARMACEUTICALS INCORPORATED 2015-10-08 US disclosed
EP-2270005-B1 Prodrug of an ice inhibitor VERTEX PHARMA (US) 2015-07-08 EP disclosed
EP-1286989-A2 PRODRUG OF AN ICE INHIBITOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2003-03-05 EP disclosed
EP-1278737-A2 PROCESS AND INTERMEDIATES FOR MAKING SUBSTITUTED ASPARTIC ACID ACETALS Vertex Pharmaceuticals Incorporated (US) 2003-01-29 EP disclosed
WO-2002057298-A2 C-TERMINAL MODIFIED OXAMYL DIPEPTIDES AS INHIBITORS OF THE ICE/CED-3 FAMILY OF CYSTEINE PROTEASES IDUN PHARMACEUTICALS, INC. (US) 2002-07-25 WO disclosed
US-20020013278-A1 Prodrug of an ice inhibitor VERTEX PHARMACEUTICALS INCORPORATED 2002-01-31 US disclosed
WO-2001090063-A2 PRODRUG OF AN ICE INHIBITOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2001-11-29 WO disclosed
WO-2001081330-A2 PROCESS AND INTERMEDIATES FOR MAKING SUBSTITUTED ASPARTIC ACID ACETALS VERTEX PHARMACEUTICALS INCORPORATED (US) 2001-11-01 WO disclosed
EP-1064298-A2 INHIBITORS OF CASPASES Vertex Pharmaceuticals Incorporated (US) 2001-01-03 EP disclosed
WO-1999047545-A2 INHIBITORS OF CASPASES VERTEX PHARMACEUTICALS INCORPORATED (US) 1999-09-23 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 (7 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-20200048306-A1 PRODRUG OF AN ICE INHIBITOR CASP1, MCL1, IL1B SMN1; SMN2 678/4885TK1 582/4885
US-20180327449-A1 PRODRUG OF AN ICE INHIBITOR CASP1, MCL1, IL1B SMN1; SMN2 678/4885TK1 582/4885
US-20170022249-A1 PRODRUG OF AN ICE INHIBITOR CASP1, MCL1, IL1B SMN1; SMN2 678/4885TK1 582/4885
US-20020013278-A1 Prodrug of an ice inhibitor CASP1, MCL1, IL1A SMN1; SMN2 770/4885TK1 505/4885
US-20030236296-A1 Novel interleukin-1beta converting enzyme inhibitors IL1R1, IL1B, IL1RN SMN1; SMN2 4073/4885TK1 1373/4885
US-20150284426-A1 PRODRUG OF AN ICE INHIBITOR CASP1, MCL1, IL1B SMN1; SMN2 678/4885TK1 582/4885
US-20040014753-A1 Novel interleukin-1beta converting enzyme inhibitors IL1B, IL1RN, IL1R1 SMN1; SMN2 4567/4885TK1 2167/4885

“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.