SCHEMBL557573

SCHEMBL557573

O=[C]c1cc(OCCCCCCCCCCCCCCC(=O)O)cc(C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.55
PPARA Q07869 4/20 0.49
ALB P02768 1/20 0.47
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
PLA2G4B P0C869 3/20 0.43
FFAR1 O14842 1/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
RARB P10826 3/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.40

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
SCHEMBL7293362 0.80 PPARA (0.59) PPARAALBPLA2G4BFFAR1
SCHEMBL31453941 0.78 MMP2 (0.54) PLA2G2APPARAALBPLA2G4BFFAR1
SCHEMBL557574 0.78 PLA2G2A (0.54) PLA2G2APPARAALBTP53TSHR
SCHEMBL2233264 0.78 PPARA (0.71) PPARATP53TSHRPLA2G4BRARB
SCHEMBL8133488 0.78 PPARA (0.71) PPARATP53TSHRPLA2G4BRARB
SCHEMBL2255415 0.78 PPARA (0.71) PPARATP53TSHRPLA2G4BRARB
SCHEMBL28279260 0.78 PPARA (0.71) PPARATP53TSHRPLA2G4BRARB
SCHEMBL11589042 0.78 PPARA (0.71) PPARATP53TSHRPLA2G4BRARB
SCHEMBL7282717 0.78 PPARA (0.54) PPARAALBPLA2G4BFFAR1
SCHEMBL29722727 0.77 KMT2A (0.67) PPARAPLA2G4BHTTKMT2A

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 10 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
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 PLA2G2A 2377/4885PPARA 179/4885ALB 957/4885
US-20080076705-A1 Insulin Derivatives IAPP, INSR, GPR119 PLA2G2A 2219/4885PPARA 250/4885ALB 1052/4885

“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.