SCHEMBL2283753

SCHEMBL2283753

Cn1cnc(-c2nnc3c4cc(-c5ccccc5)c(-c5ccc(CO)cc5)nc4ccn23)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 18/20 0.46
AKT2 P31751 13/20 0.46
KCNH2 Q12809 4/20 0.45
AKT3 Q9Y243 2/20 0.37
FECH P22830 1/20 0.37
DHODH Q02127 1/20 0.34
BAZ2B Q9UIF8 1/20 0.33
BAZ2A Q9UIF9 1/20 0.33

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
SCHEMBL2276395 0.92 AKT1 (0.48) AKT1AKT2KCNH2AKT3FECH
SCHEMBL2285870 0.87 AKT1 (0.41) AKT1AKT2KCNH2AKT3FECH
SCHEMBL2278951 0.86 AKT1 (0.41) AKT1AKT2KCNH2AKT3FECH
SCHEMBL12408734 0.86 AKT1 (0.41) AKT1AKT2KCNH2AKT3FECH
SCHEMBL2281415 0.86 AKT1 (0.41) AKT1AKT2KCNH2AKT3FECH
SCHEMBL2282035 0.86 AKT1 (0.43) AKT1AKT2KCNH2AKT3FECH
SCHEMBL2280976 0.85 AKT1 (0.42) AKT1AKT2KCNH2AKT3FECH
SCHEMBL13579036 0.84 AKT1 (0.42) AKT1AKT2KCNH2AKT3FECH
SCHEMBL3505813 0.84 AKT1 (0.43) AKT1AKT2KCNH2AKT3FECH
SCHEMBL12376153 0.84 AKT1 (0.54) AKT1AKT2AKT3FECH

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
EP-1898903-B1 INHIBITORS OF AKT ACTIVITY MERCK SHARP & DOHME (US) 2013-03-27 EP claimed
US-8008317-B2 Inhibitors of akt activtiy MERCK SHARP & DOHME CORP. (US) 2011-08-30 US claimed
EP-1898903-B1 INHIBITORS OF AKT ACTIVITY MERCK SHARP & DOHME (US) 2013-03-27 EP disclosed
US-8008317-B2 Inhibitors of akt activtiy MERCK SHARP & DOHME CORP. (US) 2011-08-30 US disclosed
US-8008317-B2 Inhibitors of akt activtiy MERCK SHARP & DOHME CORP. (US) 2011-08-30 US disclosed
US-8008317-B2 Inhibitors of akt activtiy MERCK SHARP & DOHME CORP. (US) 2011-08-30 US disclosed
US-20100222321-A1 Inhibitors of akt activtiy MERCK SHARP & DOHME LLC 2010-09-02 US disclosed
US-20100222321-A1 Inhibitors of akt activtiy MERCK SHARP & DOHME LLC 2010-09-02 US disclosed
US-20100222321-A1 Inhibitors of akt activtiy MERCK SHARP & DOHME LLC 2010-09-02 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-20100222321-A1 Inhibitors of akt activtiy PIK3CA, PIK3CD, INPP5D AKT1 8/4885AKT2 4/4885KCNH2 3672/4885

“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.