SCHEMBL2949040

SCHEMBL2949040

CCOC(=O)C(C)NC(=O)OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.57
CTSL P07711 3/20 0.57
CTSS P25774 3/20 0.57
CTSB P07858 2/20 0.57
ATM Q13315 1/20 0.57
LMNA P02545 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
HSD17B10 Q99714 1/20 0.54
CTRB1 P17538 2/20 0.54
ELANE P08246 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL2949041 1.00 CTSK (0.57) CTSKCTSLCTSSCTSBATM
SCHEMBL6897142 0.94 CTSK (0.54) CTSKCTSLCTSSCTSBATM
SCHEMBL15080869 0.92 CTSK (0.61) CTSKCTSLCTSSCTSBATM
SCHEMBL30946598 0.92 CTSK (0.61) CTSKCTSLCTSSCTSBATM
SCHEMBL11004145 0.89 CTSK (0.53) CTSKCTSLCTSSCTSBATM
SCHEMBL11004153 0.89 CTSK (0.53) CTSKCTSLCTSSCTSBATM
SCHEMBL6320137 0.89 METAP2 (0.48) CTSKCTSLCTSSCTSBATM
SCHEMBL5412160 0.88 MAPT (0.61) CTSKCTSLCTSSCTSBATM
SCHEMBL5075275 0.88 CTSK (0.60) CTSKCTSLCTSSCTSBATM
SCHEMBL939737 0.88 MAPT (0.61) CTSKCTSLCTSSCTSBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112516388-B Domain-controllable osteochondral repair composite scaffold and preparation method thereof 四川大学 2021-11-02 CN disclosed
CN-112516388-A Domain-controllable osteochondral repair composite scaffold and preparation method thereof 四川大学 2021-03-19 CN disclosed
US-8871785-B2 Antiviral phosphonate analogs GILEAD SCIENCES, INC. (US) 2014-10-28 US disclosed
US-8329926-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2012-12-11 US disclosed
US-8324179-B2 Nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-12-04 US disclosed
US-8318701-B2 Phosphonate analogs of HIV inhibitor compounds GILEAD SCIENCES, INC. (US) 2012-11-27 US disclosed
US-20110288053-A1 ANTIVIRAL PHOSPHONATE ANALOGS GILEAD SCIENCES, INC. (US) 2011-11-24 US disclosed
US-8022083-B2 Antiviral phosphonate analogs GILEAD SCIENCES, INC. (US) 2011-09-20 US disclosed
EP-2070914-B1 New antagonist derivatives of the vitronectin receptor, method for their preparation, their application as medicine and pharmaceutical compositions containing them GALAPAGOS SAS (FR) 2011-08-03 EP disclosed
US-7763621-B2 Vitronectin receptor antagonist derivatives, method for preparing same, use thereof as medicines and pharmaceutical compositions containing same GALAPAGOS SAS (FR) 2010-07-27 US disclosed
US-20090202470-A1 Phosphonate Analogs of Hiv Inhibitor Compounds GILEAD SCIENCES, INC. (US) 2009-08-13 US disclosed
US-20090149476-A1 Novel vitronectin receptor antagonist derivatives, method for preparing same, use thereof as medicines and pharmaceutical compositions containing same GALAPAGOS SAS 2009-06-11 US disclosed
US-20090029939-A1 Pre-organized tricyclic integrase inhibitor compounds GILEAD SCIENCES, INC. 2009-01-29 US disclosed
US-20090012037-A1 Antiviral Compounds GILEAD SCIENCE, INC. (US) 2009-01-08 US disclosed
US-7407965-B2 Phosphonate analogs for treating metabolic diseases GILEAD SCIENCES, INC. (US) 2008-08-05 US disclosed
US-20080171724-A1 Phosphonate Derivatives of Mycophenolic Acid GILEAD SCIENCES, INC. (US) 2008-07-17 US disclosed
US-20080167270-A1 ANTI-INFECTIVE PHOSPHONATE ANALOGS BOOJAMRA CONSTANTINE G 2008-07-10 US disclosed
US-20070281907-A1 Kinase Inhibitor Phosphonate Conjugates GILEAD SCIENCES, INC. 2007-12-06 US disclosed
US-7253180-B2 Pre-organized tricyclic integrase inhibitor compounds GILEAD SCIENCES, INC. (US) 2007-08-07 US disclosed
US-20060052398-A1 Novel vitronectin receptor antagonist derivatives, method for preparing same, use thereof as medicines and pharmaceutical compositions containing same GALAPAGOS NV (BE) 2006-03-09 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 (9 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-20060052398-A1 Novel vitronectin receptor antagonist derivatives, method for preparing same, use thereof as medicines and pharmaceutical compositions containing same ADGRF1, C5AR2, ADGRE5 CTSK 1391/4885CTSL 447/4885CTSS 1246/4885
US-20090202470-A1 Phosphonate Analogs of Hiv Inhibitor Compounds PIK3CA, TYMP, ITPA CTSK 1880/4885CTSL 1332/4885CTSS 1647/4885
US-20080167270-A1 ANTI-INFECTIVE PHOSPHONATE ANALOGS PHOSPHO1, PGLS, PSPH CTSK 1131/4885CTSL 273/4885CTSS 857/4885
US-20110288053-A1 ANTIVIRAL PHOSPHONATE ANALOGS TYMP, ITPA, PNP CTSK 2359/4885CTSL 1567/4885CTSS 2339/4885
US-20090029939-A1 Pre-organized tricyclic integrase inhibitor compounds MUS81, CDKL4, INTS6 CTSK 2845/4885CTSL 475/4885CTSS 736/4885
US-20090149476-A1 Novel vitronectin receptor antagonist derivatives, method for preparing same, use thereof as medicines and pharmaceutical compositions containing same ADGRF1, C5AR2, ADGRE5 CTSK 1391/4885CTSL 447/4885CTSS 1246/4885
US-20090012037-A1 Antiviral Compounds EIF2AK2, MAVS, ITPA CTSK 1726/4885CTSL 1165/4885CTSS 1463/4885
US-20080171724-A1 Phosphonate Derivatives of Mycophenolic Acid PPP5C, DUSP15, DUSP4 CTSK 4249/4885CTSL 4359/4885CTSS 4508/4885
US-20070281907-A1 Kinase Inhibitor Phosphonate Conjugates PIK3CA, PNKP, PLK1 CTSK 836/4885CTSL 3081/4885CTSS 3275/4885

“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.