SCHEMBL772199

SCHEMBL772199

COC(=O)N1CCC(N(C)C=O)C1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
CHRNB2 P17787 2/20 0.38
CHRNA4 P43681 2/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
PDE4B Q07343 3/20 0.37
HSD11B1 P28845 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
PGR P06401 3/20 0.36
CYP2D6 P10635 3/20 0.36
CYP2C9 P11712 3/20 0.36
JAK2 O60674 2/20 0.36
JAK1 P23458 2/20 0.36
USP30 Q70CQ3 2/20 0.36
L3MBTL3 Q96JM7 1/20 0.35

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
SCHEMBL771728 0.90 ADH1C (0.46) ADH1CADH1ACHRNB2CHRNA4CHRNB4
SCHEMBL772151 0.81 ADH1C (0.42) ADH1CADH1ACHRNB2CHRNA4CHRNB4
SCHEMBL772198 0.79 PGR (0.39) CHRNB2CHRNA4CHRNB4CHRNA3HSD11B1
SCHEMBL771282 0.76 PGR (0.38) CHRNB2CHRNA4CHRNB4CHRNA3HSD11B1
SCHEMBL14388985 0.75 L3MBTL3 (0.53) CHRNB2CHRNA4CHRNB4CHRNA3CYP2C9
SCHEMBL19473333 0.74 CYP1A2 (0.39) HSD11B1CYP2D6CYP2C9L3MBTL3
SCHEMBL771640 0.74 ADH1C (0.50) ADH1CADH1AL3MBTL3
SCHEMBL5006363 0.73 CHRNB2 (0.42) CHRNB2CHRNA4CHRNB4CHRNA3PDE4B
SCHEMBL17572098 0.71 DPP4 (0.41) CHRNB2CHRNA4CHRNB4CHRNA3L3MBTL3
SCHEMBL771727 0.70 EPHX1 (0.38) CHRNB2CHRNA4CHRNB4CHRNA3CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-03-22 US disclosed
US-7977331-B1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2011-07-12 US disclosed
EP-2206715-A1 Fused heterotetracyclic compounds and use thereof as hcv polymerase inhibitor Japan Tobacco, Inc. (JP) 2010-07-14 EP disclosed
US-7659263-B2 Thienopyrrole compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2010-02-09 US disclosed
EP-1719773-B1 FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC (JP) 2009-04-15 EP disclosed
US-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2007-03-01 US disclosed
EP-1719773-A1 FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR Japan Tobacco, Inc. (JP) 2006-11-08 EP disclosed
US-20060167246-A1 Thienopyrrole compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2006-07-27 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 (3 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-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor POLI, TERT, ZC3HAV1 ADH1C 123/4885ADH1A 807/4885CHRNB2 4884/4885
US-20060167246-A1 Thienopyrrole compound and use thereof as HCV polymerase inhibitor TPMT, JAK2, GTF3C5 ADH1C 87/4885ADH1A 363/4885CHRNB2 4885/4885
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR POLI, TERT, ZC3HAV1 ADH1C 123/4885ADH1A 807/4885CHRNB2 4884/4885

“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.