SCHEMBL1567595

SCHEMBL1567595

CC(C)(C)CN(C(=O)O)[C@H](CN)CC1CCOCC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.30

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
SCHEMBL2028717 0.85 PSEN1 (0.30)
SCHEMBL2024332 0.85 PSEN1 (0.30)
SCHEMBL2029636 0.85 PSEN1 (0.30)
SCHEMBL2023555 0.85 PSEN1 (0.30)
SCHEMBL2023388 0.85 PSEN1 (0.30)
SCHEMBL2028296 0.81 PSEN1 (0.36) PIK3CD
SCHEMBL3643875 0.81 PSEN1 (0.36) PIK3CD
SCHEMBL8002296 0.72 CTSS (0.37)
SCHEMBL2027389 0.71
SCHEMBL1567593 0.70 PIK3CD (0.33) PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110160300-A1 Renin Inhibitors and Methods of Use Thereof VITAE PHARMACEUTICALS, INC. 2011-06-30 US disclosed
EP-2307396-A1 RENIN INHIBITORS AND METHOD OF USE THEREOF Vitae Pharmaceuticals, Inc. (US) 2011-04-13 EP disclosed
US-20100160424-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2010-06-24 US disclosed
WO-2009154766-A1 RENIN INHIBITORS AND METHOD OF USE THEREOF VITAE PHARMACEUTICALS, INC. (US) 2009-12-23 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 (2 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-20100160424-A1 RENIN INHIBITORS ACE, REN, DNPEP PIK3CD 4404/4885
US-20110160300-A1 Renin Inhibitors and Methods of Use Thereof REN, ACE, AGTR1 PIK3CD 3081/4885

“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.