SCHEMBL558015

SCHEMBL558015

CC(C)(C)OC(=O)c1ccc(O)cc1.COC(=O)CCCCCCCCCOc1ccc(C(=O)OC(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
ESRRB O95718 1/20 0.45
GAA P10253 1/20 0.44
NR5A1 Q13285 1/20 0.44
RAB9A P51151 1/20 0.44
HDAC8 Q9BY41 2/20 0.43
PRKCA P17252 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA9 Q16790 3/20 0.42
CA7 P43166 1/20 0.42
CA14 Q9ULX7 1/20 0.42
ESR1 P03372 2/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL558993 0.95 MAPT (0.53) MAPTGAARAB9AHDAC8PRKCA
SCHEMBL1743906 0.95 MAPT (0.53) MAPTGAARAB9AHDAC8PRKCA
SCHEMBL26092045 0.95 MAPT (0.53) MAPTGAARAB9AHDAC8PRKCA
SCHEMBL1363883 0.90 PPARA (0.51) MAPTGAARAB9AHDAC8TSHR
SCHEMBL809948 0.85 NR5A1 (0.59) MAPTESRRBGAANR5A1HDAC8
SCHEMBL4262672 0.83 MAPT (0.70) MAPTGAARAB9AL3MBTL1CA1
SCHEMBL2921102 0.82 PDE3B (0.41) MAPTGAAHDAC8
SCHEMBL2183439 0.82 PPARA (0.58) MAPTGAAHDAC8L3MBTL1TSHR
SCHEMBL20567660 0.82 PPARA (0.58) MAPTGAAHDAC8L3MBTL1TSHR
SCHEMBL1745096 0.82 PPARA (0.58) MAPTGAAHDAC8L3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE46170-E1 Insulin derivatives NOVO NORDISK A/S (DK) 2016-10-04 US disclosed
EP-2256130-B1 Novel insulin derivatives NOVO NORDISK AS (DK) 2013-09-25 EP disclosed
US-8476228-B2 Insulin derivatives NOVO NORDISK A/S (DK) 2013-07-02 US disclosed
EP-1846446-B1 INSULIN DERIVATIVES NOVO NORDISK AS (DK) 2013-06-26 EP disclosed
US-20120035104-A1 Insulin derivatives NOVO NORDISK A/S (DK) 2012-02-09 US disclosed
US-8067362-B2 Antidiabetic agents; genetic engineered polypeptide; having a side chain attached alpha -amino group of the N-terminal amino acid of the B chain via an amide bond, with free carboxylic acid group, a fatty acid; soluble at physiological pH, prolonged profile of action; hypoglycemic agents NOVO NORDISK AS (DK) 2011-11-29 US disclosed
EP-2256130-A1 Novel insulin derivatives Novo Nordisk A/S (DK) 2010-12-01 EP disclosed
EP-2015770-A2 INSULIN DERIVATIVE Novo Nordisk A/S (DK) 2009-01-21 EP disclosed
US-20080076705-A1 Insulin Derivatives NOVO NORDISK A/S (DK) 2008-03-27 US disclosed
WO-2007128817-A2 INSULIN DERIVATIVE NOVO NORDISK A/S (DK) 2007-11-15 WO disclosed
EP-1846446-A1 INSULIN DERIVATIVES NOVO NORDISK A/S (DK) 2007-10-24 EP disclosed
WO-2006082204-A1 INSULIN DERIVATIVES NOVO NORDISK A/S (DK) 2006-08-10 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 (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-20120035104-A1 Insulin derivatives IAPP, INSR, GPR119 MAPT 4024/4885ESRRB 915/4885GAA 770/4885
US-20080076705-A1 Insulin Derivatives IAPP, INSR, GPR119 MAPT 4130/4885ESRRB 932/4885GAA 801/4885

“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.