SCHEMBL6478475

SCHEMBL6478475

COC(=O)CCC(=O)Nc1n[nH]c2cc(Cl)ccc12

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 18/20 0.77
HDAC1 Q13547 2/20 0.56
HDAC2 Q92769 2/20 0.56
HDAC8 Q9BY41 2/20 0.56
CYP1A2 P05177 2/20 0.52

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
SCHEMBL4497072 0.87 GSK3B (1.00) GSK3BCYP1A2
SCHEMBL1461358 0.86 GSK3B (1.00) GSK3BHDAC1HDAC2HDAC8
SCHEMBL6491225 0.83 GSK3B (0.82) GSK3BHDAC1HDAC2HDAC8CYP1A2
SCHEMBL15484479 0.83 GSK3B (0.90) GSK3BCYP1A2
SCHEMBL1461456 0.82 GSK3B (0.77) GSK3BHDAC1HDAC2HDAC8
SCHEMBL1461244 0.82 GSK3B (0.76) GSK3BHDAC1HDAC2HDAC8
SCHEMBL1460369 0.80 GSK3B (0.74) GSK3BHDAC1HDAC2HDAC8
SCHEMBL27604440 0.80 GSK3B (0.74) GSK3BHDAC1HDAC2HDAC8
SCHEMBL1460219 0.79 GSK3B (0.71) GSK3BHDAC1HDAC2HDAC8
SCHEMBL1461243 0.78 GSK3B (0.84) GSK3BHDAC1HDAC2HDAC8CYP1A2

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
EP-1487804-B1 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2014-02-26 EP claimed
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US claimed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 US claimed
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US disclosed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 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 (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-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof CYP2C8, NR0B2, NR2C2 GSK3B 2342/4885HDAC1 1547/4885HDAC2 1193/4885

“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.