SCHEMBL8416163

SCHEMBL8416163

CC(C)(C)OC(=O)N1[C@@H](C#CC(=O)CCl)COC1(C)C

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.48
BRD4 O60885 1/20 0.36
CTSK P43235 1/20 0.32
HCRTR2 O43614 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
HSD11B2 P80365 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
SCHEMBL11956429 0.82 SPHK1 (0.48) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL25148798 0.82 SPHK1 (0.48) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL9752336 0.81 SPHK1 (0.51) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL14314018 0.81 SPHK1 (0.54) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL10272352 0.81 SPHK1 (0.54) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL10272353 0.81 SPHK1 (0.54) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL10223487 0.81 SPHK1 (0.47) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL6979603 0.78 SPHK1 (0.49) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL1833725 0.78 SPHK1 (0.49) SPHK1BRD4CTSKHCRTR2CHRM2
SCHEMBL1833726 0.78 SPHK1 (0.49) SPHK1BRD4CTSKHCRTR2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511039-B2 β-sheet mimetics and use thereof as inhibitors of biologically active peptides or proteins MYRIAD GENETICS, INC. (US) 2009-03-31 US disclosed
US-20060276408-A1 Beta-sheet mimetics and use thereof as inhibitors of biologically active peptides or proteins MYRIAD GENETICS, INCORPORATED (US) 2006-12-07 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-20060276408-A1 Beta-sheet mimetics and use thereof as inhibitors of biologically active peptides or proteins SERPINB1, SERPINE1, SERPINA2 SPHK1 2300/4885BRD4 2047/4885CTSK 239/4885

“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.