SCHEMBL13499744

SCHEMBL13499744

CC(C)NC(=O)C(CC(C)(C)C)OCC1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 4/20 0.38
SLC1A2 P43004 4/20 0.38
SLC1A1 P43005 4/20 0.38
CTSK P43235 2/20 0.34
METAP2 P50579 1/20 0.34
CTSS P25774 1/20 0.34
GPR88 Q9GZN0 2/20 0.33
CNR2 P34972 2/20 0.32
KLK7 P49862 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
LTA4H P09960 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSH P09668 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
SCHEMBL13499734 0.95 CNR2 (0.35) SLC1A3SLC1A2SLC1A1CTSKCTSS
SCHEMBL13500245 0.87 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1CTSKCTSS
SCHEMBL13435112 0.85 SLC1A3 (0.38) SLC1A3SLC1A2SLC1A1CTSKMETAP2
SCHEMBL13461401 0.84 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1CTSKMETAP2
SCHEMBL13499742 0.83 SLC1A3 (0.41) SLC1A3SLC1A2SLC1A1CTSKCTSS
SCHEMBL13499743 0.82 SLC1A3 (0.40) SLC1A3SLC1A2SLC1A1CTSKCTSS
SCHEMBL13499746 0.82 SLC1A3 (0.40) SLC1A3SLC1A2SLC1A1CTSKCTSS
SCHEMBL13499735 0.82 SLC1A3 (0.40) SLC1A3SLC1A2SLC1A1CTSKCTSS
SCHEMBL13909182 0.82 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1CTSKMETAP2
SCHEMBL13500177 0.80 CNR2 (0.41) SLC1A3SLC1A2SLC1A1CNR2

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-20100048541-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-02-25 US disclosed
US-7655647-B2 Substituted lactams as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-02-02 US disclosed
US-7655647-B2 Substituted lactams as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-02-02 US disclosed
US-20100009966-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-01-14 US disclosed
US-20090170831-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2009-07-02 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 (3 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-20100009966-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, APH1A SLC1A3 801/4885SLC1A2 537/4885SLC1A1 743/4885
US-20100048541-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, APH1A SLC1A3 801/4885SLC1A2 537/4885SLC1A1 743/4885
US-20090170831-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, APH1A SLC1A3 864/4885SLC1A2 667/4885SLC1A1 785/4885

“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.