SCHEMBL12892209

SCHEMBL12892209

O=C(Nc1nnn[nH]1)c1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ MMP3 P08254 1/20 0.51
▸ HDAC8 Q9BY41 1/20 0.51
▸ DEGS1 O15121 1/20 0.51
▸ KMT2A Q03164 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ POLB P06746 2/20 0.50
▸ PLK1 P53350 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.48
▸ CNR1 P21554 1/20 0.48
▸ GAA P10253 1/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ NR1H4 Q96RI1 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ LMNA P02545 1/20 0.46

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
SCHEMBL11442607 0.87 CNR1 (0.42) MAPTKDM4ESMN1; SMN2MMP3HDAC8
SCHEMBL11105640 0.81 KDM4E (0.60) KDM4ESMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL9501879 0.81 NPC1 (0.56) MAPTKDM4ESMN1; SMN2HDAC8KMT2A
SCHEMBL11087477 0.80 HDAC1 (0.47) MAPTKDM4ESMN1; SMN2HDAC8KMT2A
SCHEMBL11195781 0.80 MAPT (0.55) MAPTKDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL12892210 0.79 JAK2 (0.55) MAPTSMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL1250218 0.79 ALDH1A1 (0.50) MAPTKDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL2662445 0.79 ALPL (0.61) MAPTKDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL11091292 0.79 PARP14 (0.41) MAPTKDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL10792371 0.78 POLB (0.46) MAPTKDM4EKMT2ANPC1RAB9A

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 5 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-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 MAPT 1785/4885KDM4E 4599/4885SMN1; SMN2 2958/4885

“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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