SCHEMBL12989865

SCHEMBL12989865

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)CCCCCNC(=O)CCCCC1SC[C@@H]2NC(=O)N[C@H]12)OC(=O)CCCCCCCCCCCCCCC

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 2/20 0.68
▸ CNR1 P21554 3/20 0.64
▸ PLCD1 P51178 1/20 0.56
▸ F2 P00734 1/20 0.54
▸ PRSS1 P07477 1/20 0.54
▸ PRSS2 P07478 1/20 0.54
▸ PRSS3 P35030 1/20 0.54
▸ TPSAB1 Q15661 1/20 0.54
▸ TDP1 Q9NUW8 2/20 0.50
▸ NAPEPLD Q6IQ20 1/20 0.50
▸ FABP3 P05413 1/20 0.47
▸ FOLH1 Q04609 2/20 0.47
▸ HPSE Q9Y251 1/20 0.46
▸ HLCS P50747 2/20 0.45
▸ LPAR1 Q92633 1/20 0.45
▸ LPAR3 Q9UBY5 1/20 0.45
▸ SMPD1 P17405 1/20 0.44
▸ CAPN1 P07384 1/20 0.44

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
SCHEMBL30165784 0.99 CNR2 (0.66) CNR2CNR1PLCD1F2PRSS1
SCHEMBL10140249 0.99 CNR2 (0.66) CNR2CNR1PLCD1F2PRSS1
SCHEMBL16419858 0.92 CNR2 (0.59) CNR2CNR1PLCD1F2PRSS1
SCHEMBL28660549 0.92 CNR2 (0.59) CNR2CNR1PLCD1F2PRSS1
SCHEMBL29688513 0.92 CNR2 (0.78) CNR2CNR1PLCD1F2PRSS1
SCHEMBL29700479 0.92 CNR2 (0.67) CNR2CNR1PLCD1F2PRSS1
SCHEMBL29910364 0.92 CNR2 (0.73) CNR2CNR1PLCD1F2PRSS1
SCHEMBL12582940 0.91 CNR2 (0.66) CNR2CNR1PLCD1F2PRSS1
SCHEMBL15746589 0.91 CNR1 (0.64) CNR2CNR1PLCD1F2PRSS1
SCHEMBL29758823 0.90 CNR2 (0.64) CNR2CNR1PLCD1F2PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9145453-B2 Orally bioavailable lipid-based constructs SDG, INC. (US) 2015-09-29 — — US disclosed
US-8962015-B2 Orally bioavailable lipid-based constructs SDG, INC. (US) 2015-02-24 — — US disclosed
US-8846053-B2 Orally bioavailable lipid-based constructs SDG, INC. (US) 2014-09-30 — — US disclosed
US-20100310599-A1 Orally Bioavailable Lipid-Based Constructs SDG, INC. 2010-12-09 — — US disclosed
US-20100247625-A1 Orally Bioavailable Lipid-Based Constructs SDG, INC. 2010-09-30 — — US disclosed
US-20100129428-A1 SUPRA MOLECULAR CONSTRUCT FOR DELIVERY OF INTERFERON TO A MAMMAL SDG, INC. 2010-05-27 — — US disclosed
US-20100080773-A1 Orally Bioavailable Lipid-Based Constructs SDG, INC. 2010-04-01 — — US disclosed
US-20090087479-A1 Orally bioavailable lipid-based constructs SDG, INC. ( AN OHIO CORPORATION) (US) 2009-04-02 — — US disclosed
US-20070218117-A1 Supra molecular construct for delivery of interferon to a mammal SDG, INC. 2007-09-20 — — 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 (6 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-20070218117-A1 Supra molecular construct for delivery of interferon to a mammal HAVCR2, IFNAR1, MSR1 CNR2 2404/4885CNR1 1331/4885PLCD1 1876/4885
US-20100080773-A1 Orally Bioavailable Lipid-Based Constructs FABP2, FABP1, LIPC CNR2 1029/4885CNR1 1065/4885PLCD1 4686/4885
US-20100129428-A1 SUPRA MOLECULAR CONSTRUCT FOR DELIVERY OF INTERFERON TO A MAMMAL HAVCR2, IFNAR1, IFNG CNR2 2524/4885CNR1 1514/4885PLCD1 1837/4885
US-20100310599-A1 Orally Bioavailable Lipid-Based Constructs FABP2, LIPC, FABP6 CNR2 604/4885CNR1 795/4885PLCD1 2823/4885
US-20090087479-A1 Orally bioavailable lipid-based constructs FABP2, FABP1, FABP6 CNR2 670/4885CNR1 775/4885PLCD1 4631/4885
US-20100247625-A1 Orally Bioavailable Lipid-Based Constructs FABP2, LIPC, FABP6 CNR2 604/4885CNR1 795/4885PLCD1 2823/4885

“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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