SCHEMBL13499740

SCHEMBL13499740

CC(C)NC(=O)C(OCC1CC1)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 6/20 0.36
SLC1A2 P43004 6/20 0.36
SLC1A1 P43005 6/20 0.36
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
KMT2A Q03164 1/20 0.35
CNR2 P34972 8/20 0.33
CNR1 P21554 2/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
GPR88 Q9GZN0 1/20 0.32
SIGMAR1 Q99720 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
SCHEMBL13499748 0.95 SLC1A3 (0.40) SLC1A3SLC1A2SLC1A1CTSSCTSK
SCHEMBL13501749 0.83 CNR2 (0.39) SLC1A3SLC1A2SLC1A1CNR2CNR1
SCHEMBL13435110 0.82 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1KMT2ACNR2
SCHEMBL13461495 0.81 SLC1A3 (0.36) SLC1A3SLC1A2SLC1A1KMT2ACNR2
SCHEMBL13501743 0.81 SLC1A3 (0.41) SLC1A3SLC1A2SLC1A1CNR2CNR1
SCHEMBL13499741 0.80 SLC1A3 (0.45) SLC1A3SLC1A2SLC1A1PDE4APDE4B
SCHEMBL13435118 0.79 SLC1A3 (0.40) SLC1A3SLC1A2SLC1A1KMT2ACNR2
SCHEMBL13461544 0.78 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1CTSSCTSK
SCHEMBL13499734 0.78 CNR2 (0.35) SLC1A3SLC1A2SLC1A1PDE4APDE4B
SCHEMBL30170355 0.78 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1CNR2CNR1

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-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

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-20100048541-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, APH1A SLC1A3 801/4885SLC1A2 537/4885SLC1A1 743/4885

“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.