SCHEMBL3612224

SCHEMBL3612224

CCN(CC(N)CC1CCCCC1)C(=O)OCC[Si](C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 1/20 0.34
METAP2 P50579 1/20 0.33
CTSK P43235 3/20 0.32
DPP4 P27487 2/20 0.32
REN P00797 1/20 0.32
CYP3A4 P08684 1/20 0.30
ANPEP P15144 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
SCHEMBL1868000 1.00 GPR88 (0.34) GPR88METAP2CTSKDPP4REN
SCHEMBL1862541 0.91 METAP2 (0.34) GPR88METAP2CTSKDPP4REN
SCHEMBL1863146 0.89 CTSK (0.34) GPR88METAP2CTSKDPP4REN
SCHEMBL1860622 0.89 METAP2 (0.38) GPR88METAP2CTSKREN
SCHEMBL27709482 0.89 METAP2 (0.38) GPR88METAP2CTSKREN
SCHEMBL1863912 0.88 GPR88 (0.33) GPR88METAP2CTSKDPP4
SCHEMBL1863823 0.88 METAP2 (0.39) GPR88METAP2CTSKREN
SCHEMBL1867741 0.87 CTSK (0.33) GPR88METAP2CTSKDPP4REN
SCHEMBL1864027 0.87 GPR88 (0.32) GPR88METAP2CTSKDPP4REN
SCHEMBL1864029 0.87 GPR88 (0.32) GPR88METAP2CTSKDPP4REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8487108-B2 Piperidinyl carbamate intermediates for the synthesis of aspartic protease inhibitors VITAE PHARMACEUTICALS, INC. (US) 2013-07-16 US disclosed
EP-1966139-B1 ASPARTIC PROTEASE INHIBITORS VITAE PHARMACEUTICALS INC (US) 2011-12-21 EP disclosed
US-20100048636-A1 Aspartic Protease Inhibitors VITAE PHARMACEUTICALS, INC. 2010-02-25 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-20100048636-A1 Aspartic Protease Inhibitors DNPEP, PEPD, SERPINB1 GPR88 4464/4885METAP2 45/4885CTSK 152/4885

“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.