SCHEMBL557453

SCHEMBL557453

CC(C)(C)OC(=O)CCCCCCCCCCCCCCC(=O)Nc1cc(C(=O)ON2C(=O)CCC2=O)cc(C(=O)OC(C)(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.45
HTR1A P08908 3/20 0.41
HTR7 P34969 3/20 0.41
PKM P14618 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
PTPRC P08575 2/20 0.35
PTPN13 Q12923 1/20 0.35
FURIN P09958 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
F2 P00734 1/20 0.34

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
SCHEMBL1897841 0.94 HDAC8 (0.43) HDAC8HTR1AHTR7PKMALDH1A1
SCHEMBL1744910 0.88 HDAC8 (0.51) HDAC8HTR1AHTR7PKMALDH1A1
SCHEMBL557991 0.87 HDAC8 (0.35) HDAC8HTR1AHTR7ALDH1A1KDM4E
SCHEMBL557519 0.82 HDAC8 (0.51) HDAC8HTR1AHTR7GAAHTT
SCHEMBL2927183 0.82 HSD17B10 (0.42) HDAC8HTR1AHTR7PKMALDH1A1
SCHEMBL557953 0.82 HSD17B10 (0.42) HDAC8HTR1AHTR7PKMALDH1A1
SCHEMBL556503 0.81 HDAC8 (0.36) HDAC8
SCHEMBL11914021 0.80 HTR1A (0.49) HDAC8HTR1AHTR7ALDH1A1MAPT
SCHEMBL15061945 0.80 HDAC8 (0.41) HDAC8HTR1AHTR7PKMALDH1A1
SCHEMBL558129 0.79 HDAC8 (0.40) HDAC8HTR1AHTR7PKMALDH1A1

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
US-8722620-B2 Insulin derivatives NOVO NORDISK A/S (DK) 2014-05-13 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-2256129-A1 Insulin derivatives NOVO NORDISK A/S (DK) 2010-12-01 EP disclosed
EP-1991576-B1 INSULIN DERIVATIVES NOVO NORDISK AS (DK) 2010-09-29 EP disclosed
US-20090137454-A1 Insulin Derivatives NOVO NORDISK A/S (DK) 2009-05-28 US disclosed
US-20080076705-A1 Insulin Derivatives NOVO NORDISK A/S (DK) 2008-03-27 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 (3 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-20090137454-A1 Insulin Derivatives IAPP, INSR, GPR119 HDAC8 2197/4885HTR1A 3311/4885HTR7 2622/4885
US-20120035104-A1 Insulin derivatives IAPP, INSR, GPR119 HDAC8 1374/4885HTR1A 3864/4885HTR7 2753/4885
US-20080076705-A1 Insulin Derivatives IAPP, INSR, GPR119 HDAC8 1287/4885HTR1A 4178/4885HTR7 2732/4885

“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.