SCHEMBL12892157

SCHEMBL12892157

O=C(O)c1cc2cc(-c3cccc4ccccc34)ccc2cc1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 4/20 0.74
▸ ACMSD Q8TDX5 3/20 0.74
▸ GRIN2D O15399 1/20 0.51
▸ GRIN2A Q12879 1/20 0.51
▸ GRIN2B Q13224 1/20 0.51
▸ GRIN2C Q14957 1/20 0.51
▸ XDH P47989 1/20 0.50
▸ SLC22A12 Q96S37 1/20 0.50
▸ PTPN22 Q9Y2R2 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ LDHA P00338 1/20 0.46
▸ NR4A1 P22736 1/20 0.46
▸ NR4A2 P43354 1/20 0.46
▸ NR4A3 Q92570 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SERPINE1 P05121 1/20 0.46
▸ PPARG P37231 1/20 0.45

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
SCHEMBL1247836 0.87 ACMSD (0.63) MCL1ACMSDGRIN2DGRIN2AGRIN2B
SCHEMBL2534281 0.85 MCL1 (1.00) MCL1ACMSDXDHSLC22A12MEN1
SCHEMBL9534579 0.85 MCL1 (0.78) MCL1ACMSDGRIN2DGRIN2AGRIN2B
SCHEMBL28410866 0.81 MCL1 (0.70) MCL1ACMSDXDHSLC22A12MEN1
SCHEMBL1250945 0.81 ACMSD (0.68) MCL1ACMSDGRIN2DGRIN2AGRIN2B
SCHEMBL569383 0.81 ACMSD (0.68) MCL1ACMSDGRIN2DGRIN2AGRIN2B
SCHEMBL25177116 0.78 MCL1 (0.51) MCL1ACMSDALDH1A1PPARGPPARA
SCHEMBL2349014 0.78 GRIN2D (0.61) MCL1ACMSDGRIN2DGRIN2AGRIN2B
SCHEMBL29986101 0.78 MCL1 (0.51) MCL1ACMSDALDH1A1PPARGPPARA
SCHEMBL29195637 0.78 MCL1 (0.51) MCL1ACMSDALDH1A1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7879893-B2 Zinc binding ligand; sustained release of insulin NOVO NORDISK A/S (DK) 2011-02-01 — — US disclosed
US-7879893-B2 Zinc binding ligand; sustained release of insulin NOVO NORDISK A/S (DK) 2011-02-01 — — US disclosed
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 — — US disclosed
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 — — US disclosed
EP-1585541-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING INSULIN AND LEGENDS OF INSULIN HEXAMER NOVO NORDISK AS (DK) 2007-11-14 — — EP disclosed
EP-1429763-B1 NOVEL LIGANDS FOR THE HisB10 Zn2+ SITES OF THE R-STATE INSULIN HEXAMER NOVO NORDISK AS (DK) 2007-05-30 — — EP 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 (1 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-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB MCL1 4502/4885ACMSD 4729/4885GRIN2D 2608/4885

“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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