SCHEMBL1662372

SCHEMBL1662372

O=C(O)N1CCC(c2nc(C3CCOCC3)c[nH]2)CC1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
BLM P54132 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HTR2B P41595 4/20 0.36
CNR2 P34972 1/20 0.36
FASN P49327 3/20 0.36
KDM5B Q9UGL1 1/20 0.34
HTR1A P08908 4/20 0.33
DRD2 P14416 4/20 0.33
DRD4 P21917 4/20 0.33
KCNH2 Q12809 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL12798246 0.87 ALDH1A1 (0.34) ALDH1A1POLBHPGDBLMHSD17B10
SCHEMBL1662379 0.82 RECQL (0.47) ALDH1A1HPGD
SCHEMBL9894320 0.76 HTR2B (0.38) HTR2B
SCHEMBL14782547 0.76 HTR2B (0.38) ALDH1A1POLBHPGDHTR2B
SCHEMBL14574589 0.75 POLB (0.37) ALDH1A1POLBHPGDBLMHSD17B10
SCHEMBL1662947 0.73 RBP4 (0.37) HTR2BDRD2
SCHEMBL9894217 0.73 HTR2B (0.36) HTR2BFASN
SCHEMBL6168951 0.73 HTR2B (0.51) HTR2B
SCHEMBL6166219 0.72 HTR2B (0.49) ALDH1A1HPGDHSD17B10HTR2BKCNH2
SCHEMBL6168647 0.71 HTR2B (0.41) ALDH1A1HPGDHTR2BKDM5B

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-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
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
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 ALDH1A1 2866/4885POLB 3736/4885HPGD 1659/4885

“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.