SCHEMBL17827419

SCHEMBL17827419

CC(C)C(=O)C1(NCC(F)(F)F)CC1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.30
CTSK P43235 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
SCHEMBL15116722 0.79
SCHEMBL15116908 0.76 FABP4 (0.30)
SCHEMBL19388477 0.76
SCHEMBL15125205 0.75
SCHEMBL20054420 0.75 DGAT1 (0.36) CTSK
SCHEMBL16391173 0.71 CTSL (0.34) CTSS
SCHEMBL19388569 0.68 CTSS (0.33) CTSS
SCHEMBL12667379 0.67 ALDH1A1 (0.34)
SCHEMBL17916094 0.66
SCHEMBL12397097 0.66 ALDH1A1 (0.33)

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-9717712-B2 Combinations comprising tricyclohexadecahexaene derivatives for use in the treatment of hepatitis C virus BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-01 US disclosed
US-9717712-B2 Combinations comprising tricyclohexadecahexaene derivatives for use in the treatment of hepatitis C virus BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-01 US disclosed
US-20160166547-A1 Combinations Comprising Tricyclohexadecahexaene Derivatives for Use in the Treatment of Hepatitis C Virus BRISTOL MYERS SQUIBB CO (US) 2016-06-16 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-20160166547-A1 Combinations Comprising Tricyclohexadecahexaene Derivatives for Use in the Treatment of Hepatitis C Virus HAVCR2, HCCS, MAVS CTSS 1517/4885CTSK 1962/4885

“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.