SCHEMBL4492733

SCHEMBL4492733

O=C(COc1ccc(Cl)cc1)Nc1n[nH]c2cc(-c3ccc(OC(F)(F)F)cc3)ccc12

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 15/20 0.72
HDAC1 Q13547 3/20 0.57
HDAC2 Q92769 3/20 0.57
HDAC8 Q9BY41 3/20 0.57
HDAC6 Q9UBN7 2/20 0.53
CYP1A2 P05177 1/20 0.48

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
SCHEMBL4506424 0.93 HDAC6 (0.63) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4502148 0.89 GSK3B (0.65) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4491185 0.88 GSK3B (0.64) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4499827 0.87 GSK3B (0.64) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4494630 0.87 HDAC1 (0.58) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4484182 0.86 HDAC1 (0.57) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4486772 0.85 HDAC1 (0.66) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4491275 0.84 GSK3B (0.68) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4484179 0.84 GSK3B (0.59) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4493825 0.84 GSK3B (0.78) GSK3BHDAC1HDAC2HDAC8HDAC6

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-8222261-B2 Chemical compounds GlaxoSmithKline, LLC (US) 2012-07-17 US claimed
US-20090318477-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2009-12-24 US claimed
US-7632854-B2 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2009-12-15 US claimed
US-8222261-B2 Chemical compounds GlaxoSmithKline, LLC (US) 2012-07-17 US disclosed
US-20090318477-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2009-12-24 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-20090318477-A1 CHEMICAL COMPOUNDS GPR119, GOT2, SLC5A2 GSK3B 1726/4885HDAC1 1370/4885HDAC2 786/4885

“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.