SCHEMBL11925985

SCHEMBL11925985

C#C[C@@H]1CN(C(=O)[C@H](CC(C)C)NC(=O)c2ccc(-c3nc(N4CCN(C)CC4)sc3F)cc2)[C@H]2[C@@H]1OCC2(OC)OC

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSK P43235 20/20 0.74
CTSS P25774 11/20 0.74
CTSL P07711 9/20 0.74

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
SCHEMBL21137447 1.00 CTSK (0.74) CTSKCTSSCTSL
SCHEMBL18966303 1.00 CTSK (0.74) CTSKCTSSCTSL
SCHEMBL22266814 0.95 CTSK (0.67) CTSKCTSSCTSL
SCHEMBL16493362 0.92 CTSK (0.76) CTSKCTSSCTSL
SCHEMBL11925967 0.89 CTSK (0.74) CTSKCTSSCTSL
SCHEMBL15241308 0.88 CTSK (0.74) CTSKCTSSCTSL
SCHEMBL21137665 0.88 CTSK (0.74) CTSKCTSSCTSL
SCHEMBL11925976 0.88 CTSK (0.74) CTSKCTSSCTSL
SCHEMBL21137230 0.87 CTSK (0.74) CTSKCTSSCTSL
SCHEMBL21137229 0.87 CTSK (0.74) CTSKCTSSCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11312693-B2 Protease inhibitors MEDIVIR AB (SE) 2022-04-26 US disclosed
US-20210017140-A1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2021-01-21 US disclosed
US-10723709-B2 Protease inhibitors MEDIVIR AB (SE) 2020-07-28 US disclosed
US-20170334867-A1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2017-11-23 US disclosed
US-20170334867-A1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2017-11-23 US disclosed
EP-3033345-B1 FORM 2 CRYSTALLINE POLYMORPH OF A SALT OF N-[1-6-(ETHYNYL-3-OXO-HEXAHYDRO-FURO[3,2-B]PYRROLE-4-CARBONYL)-3-METHYL-BUTYL]-4-[5-FLUORO-2-(4-METHYL-PIPERAZINYL)THIAZOL-4-YL]-BENZAMIDE USEFUL AS CYSTEINE PROTEASE INHIBITOR MEDIVIR AB (SE) 2017-07-26 EP disclosed
US-20170166538-A1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2017-06-15 US disclosed
US-20170166538-A1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2017-06-15 US disclosed
US-9650388-B2 Form 2 crystalline polymorph of a salt of N-[1-6-(ethynyl-3-oxo-hexahydro-furo[3,2-B]pyrrole-4-carbonyl)-3-methyl-butyl]-4-[5-fluoro-2-(4-methyl-piperazinyl) thiazol-4-yl]-benzamide useful as cysteine protease inhibitor MEDIVIR AB (SE) 2017-05-16 US disclosed
US-9650388-B2 Form 2 crystalline polymorph of a salt of N-[1-6-(ethynyl-3-oxo-hexahydro-furo[3,2-B]pyrrole-4-carbonyl)-3-methyl-butyl]-4-[5-fluoro-2-(4-methyl-piperazinyl) thiazol-4-yl]-benzamide useful as cysteine protease inhibitor MEDIVIR AB (SE) 2017-05-16 US disclosed
US-8735395-B2 Protease inhibitors MEDIVIR AB (SE) 2014-05-27 US disclosed
US-8735395-B2 Protease inhibitors MEDIVIR AB (SE) 2014-05-27 US disclosed
US-20130231349-A1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2013-09-05 US disclosed
US-20130231349-A1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2013-09-05 US disclosed
EP-2331548-B1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2013-09-04 EP disclosed
US-8426421-B2 Protease inhibitors MEDIVIR AB (SE) 2013-04-23 US disclosed
US-8426421-B2 Protease inhibitors MEDIVIR AB (SE) 2013-04-23 US disclosed
US-20120289519-A1 PROTEASE INHIBITORS MEDIVIR AB (SE) 2012-11-15 US disclosed
US-8242119-B2 Protease inhibitors MEDIVIR AB (SE) 2012-08-14 US disclosed
US-20110039862-A1 Protease Inhibitors MEDIVIR AB (SE) 2011-02-17 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 (8 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-20120289519-A1 PROTEASE INHIBITORS F2RL1, F2RL3, PREP CTSK 67/4885CTSS 36/4885CTSL 7/4885
US-10723709-B2 Protease inhibitors CTSK, CTSF, CTSS CTSK 1/4885CTSS 3/4885CTSL 8/4885
US-11312693-B2 Protease inhibitors CTSK, CTSF, CTSS CTSK 1/4885CTSS 3/4885CTSL 8/4885
US-20170334867-A1 PROTEASE INHIBITORS CTSK, MMP26, MMP3 CTSK 1/4885CTSS 7/4885CTSL 13/4885
US-20210017140-A1 PROTEASE INHIBITORS CTSK, CTSF, CTSS CTSK 1/4885CTSS 3/4885CTSL 8/4885
US-20110039862-A1 Protease Inhibitors CTSK, CTSF, CTSS CTSK 1/4885CTSS 3/4885CTSL 8/4885
US-20170166538-A1 PROTEASE INHIBITORS MMP8, CTSK, CTSS CTSK 2/4885CTSS 3/4885CTSL 7/4885
US-20130231349-A1 PROTEASE INHIBITORS CTSK, CTSF, CTSS CTSK 1/4885CTSS 3/4885CTSL 8/4885

“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.