SCHEMBL4763643

SCHEMBL4763643

OCCOc1cccc(OCc2ccccc2)c1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.70
CYP4A11 Q02928 1/20 0.70
MAOB P27338 5/20 0.64
ALDH1A1 P00352 1/20 0.62
RECQL P46063 1/20 0.62
NR4A2 P43354 1/20 0.58
SPHK2 Q9NRA0 1/20 0.57
SPHK1 Q9NYA1 1/20 0.57
BCHE P06276 1/20 0.56
MAOA P21397 1/20 0.54
ALOX5 P09917 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
TSHR P16473 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SMPD1 P17405 1/20 0.53

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
SCHEMBL9453126 0.88 CYP4F2 (0.64) CYP4F2CYP4A11MAOBNR4A2SPHK2
SCHEMBL7817624 0.88 GSTP1 (0.60) CYP4F2CYP4A11MAOBALDH1A1RECQL
SCHEMBL9451327 0.87 ALDH1A1 (0.69) CYP4F2CYP4A11MAOBALDH1A1RECQL
SCHEMBL1268719 0.87 MAOB (0.81) CYP4F2CYP4A11MAOBNR4A2BCHE
Ethylene Glycol SCHEMBL28255824 0.86 CYP4F2 (0.70) CYP4F2CYP4A11MAOBALDH1A1NR4A2
SCHEMBL48418 0.84 ALDH1A1 (0.70) CYP4F2CYP4A11ALDH1A1RECQLKMT2A
SCHEMBL4819108 0.84 ALDH1A1 (0.64) MAOBALDH1A1RECQLNR4A2BCHE
Ethylene Glycol SCHEMBL29003668 0.83 MAOB (0.87) CYP4F2CYP4A11MAOBNR4A2SPHK2
Ethylene Glycol SCHEMBL7206927 0.82 ALDH1A1 (0.67) CYP4F2CYP4A11ALDH1A1RECQLKMT2A
SCHEMBL28545402 0.82 ALDH1A1 (0.62) CYP4F2CYP4A11ALDH1A1RECQLBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108949902-A A kind of serum small and dense low-density lipoprotein cholesterin detection reagent box 山东博科生物产业有限公司 2018-12-07 CN claimed
CN-108949902-A A kind of serum small and dense low-density lipoprotein cholesterin detection reagent box 山东博科生物产业有限公司 2018-12-07 CN disclosed
CN-108949902-A A kind of serum small and dense low-density lipoprotein cholesterin detection reagent box 山东博科生物产业有限公司 2018-12-07 CN disclosed
US-7579479-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-25 US disclosed
US-7579479-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-25 US disclosed
EP-1218361-B1 OXA- AND THIAZOLE DERIVATIVES USEFUL AS ANTIDIABETIC AND ANTIOBESITY AGENTS BRISTOL MYERS SQUIBB CO (US) 2009-01-07 EP disclosed
EP-1939188-A1 Oxa-and thiazole derivatives useful as antidiabetic and antiobesity agents Bristol-Myers Squibb Company (US) 2008-07-02 EP disclosed
EP-1283711-B1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2008-03-19 EP disclosed
US-7241780-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOLS-MYERS SQUIBB COMPANY (US) 2007-07-10 US disclosed
US-7241780-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOLS-MYERS SQUIBB COMPANY (US) 2007-07-10 US disclosed
WO-2001085170-A9 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2006-01-26 WO disclosed
US-6806369-B2 N-FORMYL-N-HYDROXY-2-(5-ISOQUINOLINOXY)ETHYLAMINE ANTI-BACTERIAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2004-10-19 US disclosed
US-20040192719-A1 Peptide deformylase inhibitors SMITHKLINE BEECHAM CORPORATION 2004-09-30 US disclosed
US-20040053932-A1 Peptide deformylase inhibtors GLAXOSMITHKLINE LLC 2004-03-18 US disclosed
EP-1283711-A4 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2003-05-21 EP disclosed
EP-1283711-A1 PEPTIDE DEFORMYLASE INHIBITORS SmithKline Beecham Corporation (US) 2003-02-19 EP disclosed
WO-2001085170-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-15 WO disclosed
US-5273993-A Antiarthritic agents; osteoporosis A. H. ROBINS COMPANY, INCORPORATED (US) 1993-12-28 US disclosed
US-5194446-A Antiarthritic agents A. H. ROBINS COMPANY, INCORPORATED (US) 1993-03-16 US disclosed
US-5025031-A Aryl and aryloxyalkyl sulfamate esters useful as anticonvulsants A. H. ROBINS CO., INC. (US) 1991-06-18 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 (2 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-20040053932-A1 Peptide deformylase inhibtors PDF, VIP, SPPL2B CYP4F2 3285/4885CYP4A11 4236/4885MAOB 1998/4885
US-20040192719-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 CYP4F2 3877/4885CYP4A11 4642/4885MAOB 2982/4885

“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.