SCHEMBL13026641

SCHEMBL13026641

COC(=O)NCCCCC(NC(=O)C(CCCCNC(=O)OC)NC(=O)C(CCCCNC(=O)OC)NC(=O)OC)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 3/20 0.47
▸ EPHX1 P07099 1/20 0.45
▸ TGM2 P21980 5/20 0.43
▸ CPB1 P15086 1/20 0.43
▸ CPB2 Q96IY4 1/20 0.43
▸ SIRT1 Q96EB6 2/20 0.41
▸ SIRT5 Q9NXA8 1/20 0.41
▸ SIRT2 Q8IXJ6 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GNPAT O15228 1/20 0.40
▸ GLP1R P43220 2/20 0.39

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
SCHEMBL13901982 0.97 CPB1 (0.46) FOLH1EPHX1TGM2CPB1CPB2
SCHEMBL13057085 0.94 FOLH1 (0.51) FOLH1EPHX1TGM2SIRT1SIRT2
SCHEMBL10017794 0.94 FOLH1 (0.51) FOLH1EPHX1TGM2SIRT1SIRT2
SCHEMBL2735587 0.84 FOLH1 (0.56) FOLH1EPHX1TGM2SIRT1SIRT5
SCHEMBL10075870 0.84 EPHX1 (0.47) EPHX1SIRT1SIRT5SIRT2
SCHEMBL15975505 0.84 TGM2 (0.48) FOLH1TGM2CPB1CPB2SIRT1
SCHEMBL12737512 0.84 ACHE (0.49) FOLH1TGM2
SCHEMBL14842646 0.83 C3AR1 (0.48) FOLH1TGM2SIRT1SIRT2SMN1; SMN2
SCHEMBL14980111 0.83 EPHX1 (0.46) FOLH1EPHX1SIRT1SIRT2
SCHEMBL14842643 0.83 C3AR1 (0.48) FOLH1TGM2SIRT1SIRT2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9173947-B2 Hydroxyapatite-targeting multiarm polymers and conjugates made therefrom NEKTAR THERAPEUTICS (US) 2015-11-03 — — US disclosed
US-20140329990-A1 Hydroxyapatite-Targeting Multiarm Polymers and Conjugates Made Therefrom NEKTAR THERAPEUTICS (US) 2014-11-06 — — US disclosed
US-20100286355-A1 Hydroxyapatite-Targeting Multiarm Polymers and Conjugates Made Therefrom NEKTAR THERAPEUTICS (US) 2010-11-11 — — 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 (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-20140329990-A1 Hydroxyapatite-Targeting Multiarm Polymers and Conjugates Made Therefrom CD44, FGF23, PTH1R FOLH1 58/4885EPHX1 799/4885TGM2 1059/4885
US-20100286355-A1 Hydroxyapatite-Targeting Multiarm Polymers and Conjugates Made Therefrom CD44, HAAO, FGF23 FOLH1 144/4885EPHX1 682/4885TGM2 1818/4885

“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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