SCHEMBL4401002

SCHEMBL4401002

O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCOCCOCCC(=O)Nc1ccc(CCC(=O)N2CCC2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 2/20 0.46
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA4 P22748 4/20 0.40
CA9 Q16790 4/20 0.40
CA14 Q9ULX7 4/20 0.40
POLB P06746 1/20 0.37
EPHX2 P34913 2/20 0.34
MAPT P10636 2/20 0.33
DRD2 P14416 1/20 0.33
TSHR P16473 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NAMPT P43490 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
CHRM1 P11229 1/20 0.32
HTR2A P28223 1/20 0.32

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
SCHEMBL4400652 1.00 OPRK1 (0.46) OPRK1CA12CA1CA2CA4
SCHEMBL4397929 0.91 POLB (0.40) OPRK1POLBEPHX2MAPTALDH1A1
SCHEMBL13643851 0.89 OPRK1 (0.49) OPRK1CA12CA1CA2CA4
SCHEMBL4397934 0.88 OPRK1 (0.45) OPRK1CA12CA1CA2CA4
SCHEMBL13880959 0.88 POLB (0.46) POLBMAPTTSHRALDH1A1MEN1
SCHEMBL4400850 0.88 POLB (0.49) OPRK1CA12CA1CA2CA4
SCHEMBL13643840 0.87 OPRK1 (0.52) OPRK1CA12CA1CA2CA4
SCHEMBL13643871 0.87 OPRK1 (0.52) OPRK1CA12CA1CA2CA4
SCHEMBL13643847 0.87 OPRK1 (0.45) OPRK1CA12CA1CA2CA4
SCHEMBL18249449 0.86 POLB (0.49) OPRK1CA12CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2793928-B1 PROCESS FOR PURIFYING A SAMPLE OF H38C2 ANTIBODY PFIZER (US) 2017-03-15 EP disclosed
US-9163227-B2 Anti-diabetic compounds COVX TECHNOLOGIES IRELAND LIMITED (IE) 2015-10-20 US disclosed
US-9163227-B2 Anti-diabetic compounds COVX TECHNOLOGIES IRELAND LIMITED (IE) 2015-10-20 US disclosed
US-8722622-B2 FGF21 conjugates and anti-diabetic uses thereof COVX TECHNOLOGIES IRELAND, LIMITED (IE) 2014-05-13 US disclosed
US-8722622-B2 FGF21 conjugates and anti-diabetic uses thereof COVX TECHNOLOGIES IRELAND, LIMITED (IE) 2014-05-13 US disclosed
WO-2013093720-A2 ANTI-DIABETIC COMPOUNDS PFIZER INC. (US) 2013-06-27 WO disclosed
US-20130164310-A1 ANTI-DIABETIC COMPOUNDS COVX TECHNOLOGIES IRELAND LIMITED 2013-06-27 US disclosed
US-20130164310-A1 ANTI-DIABETIC COMPOUNDS COVX TECHNOLOGIES IRELAND LIMITED 2013-06-27 US disclosed
US-20120282279-A1 Anti-Diabetic Compounds COVX TECHNOLOGIES IRELAND LIMITED (IE) 2012-11-08 US disclosed
US-20120282279-A1 Anti-Diabetic Compounds COVX TECHNOLOGIES IRELAND LIMITED (IE) 2012-11-08 US disclosed
WO-2012059873-A2 ANTI-DIABETIC COMPOUNDS COVX TECHNOLOGIES IRELAND, LTD. (IE) 2012-05-10 WO disclosed
US-20090098130-A1 GLUCAGON-LIKE PROTEIN-1 RECEPTOR (GLP-1R) AGONIST COMPOUNDS COVX TECHNOLOGIES IRELAND LIMITED (IE) 2009-04-16 US disclosed
US-20090098130-A1 GLUCAGON-LIKE PROTEIN-1 RECEPTOR (GLP-1R) AGONIST COMPOUNDS COVX TECHNOLOGIES IRELAND LIMITED (IE) 2009-04-16 US disclosed
WO-2008081418-A1 GLUCAGON-LIKE PROTEIN-1 RECEPTOR (GLP-1R) AGONIST COMPOUNDS COVX TECHNOLOGIES IRELAND LIMITED (IE) 2008-07-10 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-20120282279-A1 Anti-Diabetic Compounds GLP1R, FGF2, FGFR1 OPRK1 4623/4885CA12 1471/4885CA1 3262/4885
US-20090098130-A1 GLUCAGON-LIKE PROTEIN-1 RECEPTOR (GLP-1R) AGONIST COMPOUNDS GLP1R, GIPR, GCGR OPRK1 1995/4885CA12 2579/4885CA1 3048/4885

“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.