SCHEMBL10310588

SCHEMBL10310588

CCOC(=O)NCCCCC(NC(=O)OCC)C(=O)NCCOCCCC=O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.41
▸ SIRT1 Q96EB6 4/20 0.39
▸ SIRT2 Q8IXJ6 3/20 0.39
▸ TLR2 O60603 4/20 0.39
▸ SIRT6 Q8N6T7 1/20 0.39
▸ TGM2 P21980 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ EP300 Q09472 1/20 0.37
▸ MEF2D Q14814 1/20 0.37
▸ SIRT3 Q9NTG7 2/20 0.37

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
SCHEMBL837024 0.87 GLP1R (0.42) GLP1RSIRT1SIRT2TLR2SIRT6
SCHEMBL12695715 0.85 GLP1R (0.39) GLP1RSIRT1TLR2SIRT6TGM2
SCHEMBL2607889 0.83 SIRT2 (0.45) SIRT1SIRT2SIRT6TGM2HDAC4
SCHEMBL836829 0.83 ACHE (0.44) —
SCHEMBL2607891 0.82 SIRT1 (0.44) SIRT1SIRT2SIRT6HDAC4EP300
SCHEMBL12410205 0.81 SIRT1 (0.49) SIRT1SIRT2SIRT6HDAC4EP300
SCHEMBL13749785 0.81 SIRT6 (0.48) GLP1RSIRT1TLR2SIRT6
SCHEMBL13311516 0.81 SIRT2 (0.45) SIRT1SIRT2SIRT6HDAC4EP300
SCHEMBL17486501 0.80 EPHX2 (0.39) SIRT1SIRT2TGM2HDAC4EP300
SCHEMBL12583936 0.79 SIRT1 (0.47) SIRT1SIRT2SIRT6HDAC4EP300

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9446139-B2 Polymer-based compositions and conjugates of HIV entry inhibitors NEKTAR THERAPEUTICS (US) 2016-09-20 — — US disclosed
US-20160175402-A1 POLYMER-FACTOR VIII MOIETY CONJUGATES NEKTAR THERAPEUTICS 2016-06-23 — — US disclosed
US-8889831-B2 Unit dosage forms of pharmaceutical compositions comprising a polymer-factor VIII polypeptide conjugate NEKTAR THERAPEUTICS (US) 2014-11-18 — — US disclosed
US-20120178692-A1 DOSAGE FORMS OF POLYMER-FACTOR VIII MOIETY CONJUGATES NEKTAR THERAPEUTICS (US) 2012-07-12 — — US disclosed
US-20110318322-A1 Conjugates of a Lysosomal Enzyme Moiety and a Water Soluble Polymer NEKTAR THERAPEUTICS (US) 2011-12-29 — — US disclosed
US-20110171160-A1 POLYMER CONJUGATES OF KISS1 PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 — — US disclosed
US-20110171166-A1 POLYMER CONJUGATES OF OSTEOCALCIN PEPTIDES NEKTAR THERAPEUTICS 2011-07-14 — — 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 (5 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-20110171160-A1 POLYMER CONJUGATES OF KISS1 PEPTIDES KISS1R, PROKR1, NGLY1 GLP1R 13/4885SIRT1 473/4885SIRT2 1016/4885
US-20160175402-A1 POLYMER-FACTOR VIII MOIETY CONJUGATES F8, F9, F13B GLP1R 4739/4885SIRT1 4382/4885SIRT2 4157/4885
US-20120178692-A1 DOSAGE FORMS OF POLYMER-FACTOR VIII MOIETY CONJUGATES F8, F9, F13B GLP1R 4662/4885SIRT1 4220/4885SIRT2 4051/4885
US-20110171166-A1 POLYMER CONJUGATES OF OSTEOCALCIN PEPTIDES SOST, PTMS, ALPP GLP1R 354/4885SIRT1 1581/4885SIRT2 2572/4885
US-20110318322-A1 Conjugates of a Lysosomal Enzyme Moiety and a Water Soluble Polymer GAA, MAN2B1, GBA1 GLP1R 2600/4885SIRT1 3115/4885SIRT2 3364/4885

“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.

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