SCHEMBL1662358

SCHEMBL1662358

CC(C)(C)OC(=O)N1CCC(c2nc(Cl)c(Cl)[nH]2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
MAPT P10636 1/20 0.50
THRB P10828 1/20 0.50
HPGDS O60760 2/20 0.49
HTT P42858 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HPGD P15428 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
USP2 O75604 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GPR119 Q8TDV5 3/20 0.44
ALDH1A1 P00352 1/20 0.44
CNR1 P21554 1/20 0.44
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.42

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
SCHEMBL20909015 0.85 IRAK4 (0.40) MAPTHTTMEN1KMT2AHSD17B10
SCHEMBL16992152 0.83 ALDH1A1 (0.49) KDM4EMAPTTHRBHTTMEN1
SCHEMBL947009 0.82 KDM4E (0.53) KDM4EMAPTTHRBHPGDSHTT
SCHEMBL1662534 0.81 KDM4E (0.49) KDM4EMAPTTHRBHPGDSHTT
SCHEMBL14447473 0.80 MAPT (0.49) KDM4EMAPTTHRBHPGDSHTT
SCHEMBL1665015 0.80 KDM4E (0.51) KDM4EMAPTTHRBHPGDSHTT
SCHEMBL15556094 0.80 KDM4E (0.51) KDM4EMAPTTHRBHPGDSHTT
SCHEMBL1664728 0.79 HTR2B (0.40) HTTHPGDNPSR1ALDH1A1LMNA
SCHEMBL18291891 0.78 ALDH1A1 (0.46) MAPTHTTMEN1KMT2ANPSR1
SCHEMBL2899508 0.77 THRB (0.51) KDM4EMAPTTHRBHPGDSHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2491032-B1 AKT INHIBITORS LILLY CO ELI (US) 2014-04-16 EP disclosed
EP-2491032-B1 AKT INHIBITORS LILLY CO ELI (US) 2014-04-16 EP disclosed
US-8436002-B2 AKT inhibitors ELI LILLY AND COMPANY (US) 2013-05-07 US disclosed
US-8436002-B2 AKT inhibitors ELI LILLY AND COMPANY (US) 2013-05-07 US disclosed
EP-2491032-A1 AKT INHIBITORS Eli Lilly and Company (US) 2012-08-29 EP disclosed
US-20120149684-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2012-06-14 US disclosed
US-20120149684-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2012-06-14 US disclosed
US-20120149684-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2012-06-14 US disclosed
WO-2011050016-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2011-04-28 WO disclosed
WO-2011050016-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2011-04-28 WO 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-20120149684-A1 AKT INHIBITORS AKT2, PIK3CA, AKT3 KDM4E 1851/4885MAPT 2496/4885THRB 2880/4885

“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.