SCHEMBL692636

SCHEMBL692636

COC(=O)C1(O)CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
JAK3 P52333 2/20 0.36
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CTSK P43235 1/20 0.36
EPHX1 P07099 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
HPGD P15428 1/20 0.34
EPHX2 P34913 1/20 0.34
NR1H2 P55055 1/20 0.32
NAMPT P43490 1/20 0.32

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
SCHEMBL4437296 1.00 GRIN2B (0.40) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL4309286 1.00 GRIN2B (0.40) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL3554328 0.89 GRIN2B (0.39) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL2774828 0.84 GRIN2B (0.41) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL1268184 0.84 GRIN2B (0.41) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL199926 0.84 GRIN2B (0.41) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL5578431 0.84 GRIN2B (0.38) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL3000663 0.81 GRIN2B (0.40) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL3000664 0.81 GRIN2B (0.40) GRIN2BGRIN2CJAK3USP2SMN1; SMN2
SCHEMBL10039817 0.81 GRIN2B (0.40) GRIN2BGRIN2CJAK3USP2SMN1; 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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2429568-B1 MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS ENANTA PHARM INC (US) 2016-08-17 EP disclosed
EP-2422791-B1 ANTIVIRAL PHOSPHINATE COMPOUNDS GILEAD SCIENCES INC (US) 2014-12-17 EP disclosed
US-8674088-B2 Antiviral phosphinate compounds GILEAD SCIENCES, INC. (US) 2014-03-18 US disclosed
EP-2316839-B1 ANTIVIRAL HETEROCYCLIC COMPOUNDS HAVING PHOSPHONATE GROUPS GILEAD SCIENCES INC (US) 2014-03-12 EP disclosed
US-8586744-B2 Antiviral phosphinate compounds GILEAD SCIENCES, INC. (US) 2013-11-19 US disclosed
US-8383583-B2 Macrocyclic, pyridazinone-containing hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2013-02-26 US disclosed
EP-2043658-B1 ANTIVIRAL PHOSPHINATE COMPOUNDS GILEAD SCIENCES INC (US) 2012-04-25 EP disclosed
EP-2422791-A1 Antiviral phosphinate compounds Gilead Sciences, Inc. (US) 2012-02-29 EP disclosed
EP-1778702-B1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES INC (US) 2011-07-13 EP disclosed
EP-2316839-A1 Antiviral compounds GILEAD SCIENCES, INC. (US) 2011-05-04 EP disclosed
US-20080267917-A1 N-FUNCTIONALIZED AMIDES AS HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2008-10-30 US disclosed
US-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity VICURON HOLDINGS LLC 2008-03-06 US disclosed
US-20080057031-A1 Antiviral phosphinate compounds GILEAD SCIENCES, INC. (US) 2008-03-06 US disclosed
WO-2008019266-A2 ACYCLIC, PYRIDAZINONE-DERIVED HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2008-02-14 WO disclosed
US-20080039375-A1 Phosphorus-containing hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. 2008-02-14 US disclosed
WO-2008005565-A2 ANTIVIRAL PHOSPHINATE COMPOUNDS GILEAD SCIENCES, INC. (US) 2008-01-10 WO disclosed
EP-1539744-A4 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARM INC (US) 2007-06-06 EP disclosed
US-20060122123-A1 Antiviral compounds GILEAD SCIENCES, INC. 2006-06-08 US disclosed
EP-1539744-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2005-06-15 EP disclosed
WO-2004007444-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2004-01-22 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 (5 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-20080057031-A1 Antiviral phosphinate compounds PHOSPHO1, MAVS, ITPA GRIN2B 2401/4885GRIN2C 1932/4885JAK3 1494/4885
US-20080267917-A1 N-FUNCTIONALIZED AMIDES AS HEPATITIS C SERINE PROTEASE INHIBITORS PRSS1, HPN, SPINT2 GRIN2B 4502/4885GRIN2C 3968/4885JAK3 1783/4885
US-20060122123-A1 Antiviral compounds EIF2AK2, MAVS, ITPA GRIN2B 3278/4885GRIN2C 2994/4885JAK3 1129/4885
US-20080039375-A1 Phosphorus-containing hepatitis C serine protease inhibitors PRSS1, PPP4C, G6PC1 GRIN2B 4659/4885GRIN2C 4385/4885JAK3 1351/4885
US-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity AMDHD2, OGA, ENGASE GRIN2B 3167/4885GRIN2C 3498/4885JAK3 2543/4885

“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.