SCHEMBL3607292

SCHEMBL3607292

CN(CC(N)CC1CCCCCC1)C(=O)OCC[Si](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.36
GPR88 Q9GZN0 1/20 0.35
CTSL P07711 2/20 0.33
CTSB P07858 2/20 0.33
DPP4 P27487 2/20 0.33
CTSH P09668 1/20 0.33
METAP2 P50579 2/20 0.32
METAP1 P53582 1/20 0.32
ALOX5 P09917 1/20 0.31

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
SCHEMBL3607293 1.00 CTSK (0.36) CTSKGPR88CTSLCTSBDPP4
SCHEMBL499255 1.00 CTSK (0.36) CTSKGPR88CTSLCTSBDPP4
SCHEMBL499254 1.00 CTSK (0.36) CTSKGPR88CTSLCTSBDPP4
SCHEMBL1866462 0.99 CTSK (0.34) CTSKGPR88CTSLCTSBDPP4
SCHEMBL1866461 0.99 CTSK (0.34) CTSKGPR88CTSLCTSBDPP4
SCHEMBL1862797 0.94 ANPEP (0.33) GPR88
SCHEMBL1862799 0.94 ANPEP (0.33) GPR88
SCHEMBL499737 0.89 PIK3CD (0.30)
SCHEMBL499738 0.89 PIK3CD (0.30)
SCHEMBL3611059 0.89 ANPEP (0.31) GPR88

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
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
EP-1966139-A1 ASPARTIC PROTEASE INHIBITORS Vitae Pharmaceuticals, Inc. (US) 2008-09-10 EP disclosed
WO-2007070201-A1 ASPARTIC PROTEASE INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-06-21 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-20100048636-A1 Aspartic Protease Inhibitors DNPEP, PEPD, SERPINB1 CTSK 152/4885GPR88 4464/4885CTSL 76/4885

“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.