SCHEMBL557761

SCHEMBL557761

CC(C)(C)OC(=O)CCNCc1cccc(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 6/20 0.51
NR1H4 Q96RI1 1/20 0.50
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
UNG P13051 2/20 0.47
SLC7A5 Q01650 1/20 0.46
MYC P01106 1/20 0.46
HIF1A Q16665 1/20 0.45
FOLH1 Q04609 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
FABP4 P15090 1/20 0.42
MRGPRX4 Q96LA9 2/20 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
SCHEMBL16355779 0.90 SLC7A5 (0.55) MEP1BNR1H4CA1CA2UNG
SCHEMBL5038405 0.87 MEP1B (0.60) MEP1BNR1H4CA1CA2UNG
SCHEMBL9102803 0.85 ATM (0.52) CA1
SCHEMBL13145859 0.84 SLC7A5 (0.42) MEP1BNR1H4CA1CA2SLC7A5
SCHEMBL557679 0.84 ALDH1A1 (0.49) NR1H4SMN1; SMN2
SCHEMBL18045829 0.82 FOLH1 (0.49) NR1H4SLC7A5FOLH1SMN1; SMN2MRGPRX4
SCHEMBL7611802 0.82 SLC7A5 (0.58) MEP1BNR1H4CA1CA2UNG
SCHEMBL406503 0.80 SCN8A (0.51) MEP1BFOLH1
SCHEMBL22398380 0.79 SLC7A5 (0.49) MEP1BSLC7A5HIF1ASMN1; SMN2
SCHEMBL184425 0.79 NR1H4 (0.61) MEP1BNR1H4CA1SLC7A5FOLH1

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 15 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
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
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
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
US-20080076705-A1 Insulin Derivatives NOVO NORDISK A/S (DK) 2008-03-27 US disclosed
US-20080076705-A1 Insulin Derivatives NOVO NORDISK A/S (DK) 2008-03-27 US disclosed
US-20080076705-A1 Insulin Derivatives NOVO NORDISK A/S (DK) 2008-03-27 US 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 MEP1B 527/4885NR1H4 539/4885CA1 1913/4885
US-20080076705-A1 Insulin Derivatives IAPP, INSR, GPR119 MEP1B 848/4885NR1H4 473/4885CA1 1560/4885

“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.